N-(2-methylpropyl)-N-(phenylmethyl)isoquinoline-1-carboxamide

Systemtic Name: N-(2-methylpropyl)-N-(phenylmethyl)isoquinoline-1-carboxamide Openeye Name: N-benzyl-N-isobutyl-isoquinoline-1-carboxamide CAS Name: N-(2-methylpropyl)-N-(phenylmethyl)-1-isoquinolinecarboxamide IUPAC Name: N-benzyl-N-(2-methylpropyl)isoquinoline-1-carboxamide Traditional Name: N-benzyl-N-isobutyl-isoquinoline-1-carboxamide Formula: C21H22N2O MolecularWeight: 318.41218

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CC=C1)C(=O)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)CN(CC1=CC=CC=C1)C(=O)C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O/c1-16(2)14-23(15-17-8-4-3-5-9-17)21(24)20-19-11-7-6-10-18(19)12-13-22-20/h3-13,16H,14-15H2,1-2H3