6,7-dimethoxy-N-(3-methylphenyl)-2-(2-methylpropyl)-1-oxidanylidene-N-propyl-isoquinoline-4-carboxamide

Systemtic Name: 6,7-dimethoxy-N-(3-methylphenyl)-2-(2-methylpropyl)-1-oxidanylidene-N-propyl-isoquinoline-4-carboxamide Openeye Name: 2-isobutyl-6,7-dimethoxy-N-(m-tolyl)-1-oxo-N-propyl-isoquinoline-4-carboxamide CAS Name: 6,7-dimethoxy-N-(3-methylphenyl)-2-(2-methylpropyl)-1-oxo-N-propyl-4-isoquinolinecarboxamide IUPAC Name: 6,7-dimethoxy-N-(3-methylphenyl)-2-(2-methylpropyl)-1-oxo-N-propylisoquinoline-4-carboxamide Traditional Name: 2-isobutyl-1-keto-6,7-dimethoxy-N-(m-tolyl)-N-propyl-isoquinoline-4-carboxamide Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC(=C1)C)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

Isomeric SMILES

CCCN(C1=CC=CC(=C1)C)C(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)CC(C)C

InChI

InChI=1S/C26H32N2O4/c1-7-11-28(19-10-8-9-18(4)12-19)26(30)22-16-27(15-17(2)3)25(29)21-14-24(32-6)23(31-5)13-20(21)22/h8-10,12-14,16-17H,7,11,15H2,1-6H3