methyl 3-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[4-(2,5-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[4-(2,5-dimethylphenyl)-4-oxo-butanoyl]amino]-4-methyl-benzoate CAS Name: 3-[[4-(2,5-dimethylphenyl)-1,4-dioxobutyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[4-(2,5-dimethylphenyl)-4-oxobutanoyl]amino]-4-methylbenzoate Traditional Name: 3-[[4-(2,5-dimethylphenyl)-4-keto-butanoyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO4/c1-13-5-6-14(2)17(11-13)19(23)9-10-20(24)22-18-12-16(21(25)26-4)8-7-15(18)3/h5-8,11-12H,9-10H2,1-4H3,(H,22,24)