5-azanyl-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 5-azanyl-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 5-amino-2-benzyl-isoquinolin-1-one CAS Name: 5-amino-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 5-amino-2-benzylisoquinolin-1-one Traditional Name: 5-amino-2-benzyl-isocarbostyril Formula: C16H14N2O MolecularWeight: 250.29516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC3=C(C2=O)C=CC=C3N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC3=C(C2=O)C=CC=C3N

InChI

InChI=1S/C16H14N2O/c17-15-8-4-7-14-13(15)9-10-18(16(14)19)11-12-5-2-1-3-6-12/h1-10H,11,17H2