dimethyl 5-[[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-(3,4-dimethylphenyl)-4-oxo-butanoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[4-(3,4-dimethylphenyl)-1,4-dioxobutyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-(3,4-dimethylphenyl)-4-oxobutanoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-(3,4-dimethylphenyl)-4-keto-butanoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C

InChI

InChI=1S/C22H23NO6/c1-13-5-6-15(9-14(13)2)19(24)7-8-20(25)23-18-11-16(21(26)28-3)10-17(12-18)22(27)29-4/h5-6,9-12H,7-8H2,1-4H3,(H,23,25)