N-[4-(cyanomethyl)phenyl]-3-[4-[[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]methyl]phenyl]propanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-3-[4-[[4,5-dimethoxy-2-methyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]methyl]phenyl]propanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-[4-[(4,5-dimethoxy-2-methyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)methyl]phenyl]propanamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-[4-[(4,5-dimethoxy-2-methyl-3,6-dioxo-1-cyclohexa-1,4-dienyl)methyl]phenyl]propanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-[4-[(4,5-dimethoxy-2-methyl-3,6-dioxocyclohexa-1,4-dien-1-yl)methyl]phenyl]propanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-3-[4-[(3,6-diketo-4,5-dimethoxy-2-methyl-cyclohexa-1,4-dien-1-yl)methyl]phenyl]propionamide Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)OC)OC)CC2=CC=C(C=C2)CCC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)OC)OC)CC2=CC=C(C=C2)CCC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C27H26N2O5/c1-17-22(25(32)27(34-3)26(33-2)24(17)31)16-20-6-4-18(5-7-20)10-13-23(30)29-21-11-8-19(9-12-21)14-15-28/h4-9,11-12H,10,13-14,16H2,1-3H3,(H,29,30)