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

Systemtic Name: N-[3-[ethyl-(3-methylphenyl)amino]propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-isobutyl-6,7-dimethoxy-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[3-(N-ethyl-3-methylanilino)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[3-(N-ethyl-3-methylanilino)propyl]-6,7-dimethoxy-2-(2-methylpropyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[3-(N-ethyl-3-methyl-anilino)propyl]-2-isobutyl-1-keto-6,7-dimethoxy-isoquinoline-4-carboxamide Formula: C28H37N3O4 MolecularWeight: 479.61108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCNC(=O)C1=CN(C(=O)C2=CC(=C(C=C21)OC)OC)CC(C)C)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCCNC(=O)C1=CN(C(=O)C2=CC(=C(C=C21)OC)OC)CC(C)C)C3=CC=CC(=C3)C

InChI

InChI=1S/C28H37N3O4/c1-7-30(21-11-8-10-20(4)14-21)13-9-12-29-27(32)24-18-31(17-19(2)3)28(33)23-16-26(35-6)25(34-5)15-22(23)24/h8,10-11,14-16,18-19H,7,9,12-13,17H2,1-6H3,(H,29,32)