Name: Name:(1R)-3,4-Dihydro-1-phenyl-2(1H)-isoquinolinecarboxylic acid ethyl ester
Brand: Angene
SKU: AG00ABFW
Rating: 90 (10 reviews)

(1R)-3,4-Dihydro-1-phenyl-2(1H)-isoquinolinecarboxylic acid ethyl ester

CAS No.:

180468-41-1

Catalog Number:

AG00ABFW

Molecular Formula:

C18H19NO2

Molecular Weight:

281.3490

Catalog Number:

AG00ABFW

Chemical Name:

(1R)-3,4-Dihydro-1-phenyl-2(1H)-isoquinolinecarboxylic acid ethyl ester

CAS Number:

180468-41-1

Molecular Formula:

C18H19NO2

Molecular Weight:

281.3490

MDL Number:

MFCD17488799

IUPAC Name:

ethyl (1R)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

InChI:

InChI=1S/C18H19NO2/c1-2-21-18(20)19-13-12-14-8-6-7-11-16(14)17(19)15-9-4-3-5-10-15/h3-11,17H,2,12-13H2,1H3/t17-/m1/s1

InChI Key:

DKKVDRQVNMALLN-QGZVFWFLSA-N

SMILES:

CCOC(=O)N1CCc2c([C@H]1c1ccccc1)cccc2

Complexity:

351

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.355g/mol

Monoisotopic Mass:

281.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7