(3R)-3-azanyl-N-(1-oxidanylidene-2H-isoquinolin-6-yl)-3-phenyl-propanamide

Systemtic Name: (3R)-3-azanyl-N-(1-oxidanylidene-2H-isoquinolin-6-yl)-3-phenyl-propanamide Openeye Name: (3R)-3-amino-N-(1-oxo-2H-isoquinolin-6-yl)-3-phenyl-propanamide CAS Name: (3R)-3-amino-N-(1-oxo-2H-isoquinolin-6-yl)-3-phenylpropanamide IUPAC Name: (3R)-3-amino-N-(1-oxo-2H-isoquinolin-6-yl)-3-phenylpropanamide Traditional Name: (3R)-3-amino-N-(1-keto-2H-isoquinolin-6-yl)-3-phenyl-propionamide Formula: C18H17N3O2 MolecularWeight: 307.34648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NC2=CC3=C(C=C2)C(=O)NC=C3)N

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](CC(=O)NC2=CC3=C(C=C2)C(=O)NC=C3)N

InChI

InChI=1S/C18H17N3O2/c19-16(12-4-2-1-3-5-12)11-17(22)21-14-6-7-15-13(10-14)8-9-20-18(15)23/h1-10,16H,11,19H2,(H,20,23)(H,21,22)/t16-/m1/s1