1-chloranyl-N-(phenylmethyl)isoquinoline-3-carboxamide

Systemtic Name: 1-chloranyl-N-(phenylmethyl)isoquinoline-3-carboxamide Openeye Name: N-benzyl-1-chloro-isoquinoline-3-carboxamide CAS Name: 1-chloro-N-(phenylmethyl)-3-isoquinolinecarboxamide IUPAC Name: N-benzyl-1-chloroisoquinoline-3-carboxamide Traditional Name: N-benzyl-1-chloro-isoquinoline-3-carboxamide Formula: C17H13ClN2O MolecularWeight: 296.75092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC3=CC=CC=C3C(=N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC3=CC=CC=C3C(=N2)Cl

InChI

InChI=1S/C17H13ClN2O/c18-16-14-9-5-4-8-13(14)10-15(20-16)17(21)19-11-12-6-2-1-3-7-12/h1-10H,11H2,(H,19,21)