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

Systemtic Name: methyl 5-[[[4-(3,4-dimethylphenyl)-4-oxidanylidene-butanoyl]amino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[[4-(3,4-dimethylphenyl)-4-oxo-butanoyl]amino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[4-(3,4-dimethylphenyl)-1,4-dioxobutyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[[4-(3,4-dimethylphenyl)-4-oxobutanoyl]amino]methyl]-2-methoxybenzoate Traditional Name: 5-[[[4-(3,4-dimethylphenyl)-4-keto-butanoyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)NCC2=CC(=C(C=C2)OC)C(=O)OC)C

InChI

InChI=1S/C22H25NO5/c1-14-5-7-17(11-15(14)2)19(24)8-10-21(25)23-13-16-6-9-20(27-3)18(12-16)22(26)28-4/h5-7,9,11-12H,8,10,13H2,1-4H3,(H,23,25)