N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-7-methyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: N-homoveratryl-4-keto-7-methyl-1H-quinoline-3-carboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N2O4/c1-13-4-6-15-17(10-13)23-12-16(20(15)24)21(25)22-9-8-14-5-7-18(26-2)19(11-14)27-3/h4-7,10-12H,8-9H2,1-3H3,(H,22,25)(H,23,24)