6-[(3,4-dimethylphenyl)amino]-4,6-bis(oxidanylidene)hexanoic acid

Systemtic Name: 6-[(3,4-dimethylphenyl)amino]-4,6-bis(oxidanylidene)hexanoic acid Openeye Name: 6-(3,4-dimethylanilino)-4,6-dioxo-hexanoic acid CAS Name: 6-(3,4-dimethylanilino)-4,6-dioxohexanoic acid IUPAC Name: 6-(3,4-dimethylanilino)-4,6-dioxohexanoic acid Traditional Name: 6-(3,4-dimethylanilino)-4,6-diketo-hexanoic acid Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(=O)CCC(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC(=O)CCC(=O)O)C

InChI

InChI=1S/C14H17NO4/c1-9-3-4-11(7-10(9)2)15-13(17)8-12(16)5-6-14(18)19/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)(H,18,19)