4-[[4-[(2-methylphenyl)carbonylamino]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[4-[(2-methylphenyl)carbonylamino]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-[(2-methylbenzoyl)amino]anilino]-4-oxo-butanoic acid CAS Name: 4-[4-[[(2-methylphenyl)-oxomethyl]amino]anilino]-4-oxobutanoic acid IUPAC Name: 4-[4-[(2-methylbenzoyl)amino]anilino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[4-(o-toluoylamino)anilino]butyric acid Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H18N2O4/c1-12-4-2-3-5-15(12)18(24)20-14-8-6-13(7-9-14)19-16(21)10-11-17(22)23/h2-9H,10-11H2,1H3,(H,19,21)(H,20,24)(H,22,23)