N-[2-(3,4-diethoxyphenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6,7-dimethoxy-2-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-keto-6,7-dimethoxy-2-methyl-isoquinoline-4-carboxamide Formula: C25H30N2O6 MolecularWeight: 454.5155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CN(C(=O)C3=CC(=C(C=C32)OC)OC)C)OCC

InChI

InChI=1S/C25H30N2O6/c1-6-32-20-9-8-16(12-23(20)33-7-2)10-11-26-24(28)19-15-27(3)25(29)18-14-22(31-5)21(30-4)13-17(18)19/h8-9,12-15H,6-7,10-11H2,1-5H3,(H,26,28)