4-[[3-[(3-chloranyl-2-methyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[(3-chloranyl-2-methyl-phenyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[3-[(3-chloro-2-methyl-phenyl)carbamoyl]anilino]-4-oxo-butanoic acid CAS Name: 4-[3-[(3-chloro-2-methylanilino)-oxomethyl]anilino]-4-oxobutanoic acid IUPAC Name: 4-[3-[(3-chloro-2-methylphenyl)carbamoyl]anilino]-4-oxobutanoic acid Traditional Name: 4-[3-[(3-chloro-2-methyl-phenyl)carbamoyl]anilino]-4-keto-butyric acid Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=CC=C2)NC(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=CC=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C18H17ClN2O4/c1-11-14(19)6-3-7-15(11)21-18(25)12-4-2-5-13(10-12)20-16(22)8-9-17(23)24/h2-7,10H,8-9H2,1H3,(H,20,22)(H,21,25)(H,23,24)