N-butan-2-yl-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-2-(4-methoxyphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(4-methoxyphenyl)-1-oxo-N-sec-butyl-isoquinoline-4-carboxamide CAS Name: N-butan-2-yl-2-(4-methoxyphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-butan-2-yl-2-(4-methoxyphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 1-keto-2-(4-methoxyphenyl)-N-sec-butyl-isoquinoline-4-carboxamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N2O3/c1-4-14(2)22-20(24)19-13-23(15-9-11-16(26-3)12-10-15)21(25)18-8-6-5-7-17(18)19/h5-14H,4H2,1-3H3,(H,22,24)