2-[[2-azanyl-4-[(4-chlorophenyl)amino]-2-methyl-4-oxidanylidene-butanoyl]amino]-5-chloranyl-benzoic acid

Systemtic Name: 2-[[2-azanyl-4-[(4-chlorophenyl)amino]-2-methyl-4-oxidanylidene-butanoyl]amino]-5-chloranyl-benzoic acid Openeye Name: 2-[[2-amino-4-(4-chloroanilino)-2-methyl-4-oxo-butanoyl]amino]-5-chloro-benzoic acid CAS Name: 2-[[2-amino-4-(4-chloroanilino)-2-methyl-1,4-dioxobutyl]amino]-5-chlorobenzoic acid IUPAC Name: 2-[[2-amino-4-(4-chloroanilino)-2-methyl-4-oxobutanoyl]amino]-5-chlorobenzoic acid Traditional Name: 2-[[2-amino-4-(4-chloroanilino)-4-keto-2-methyl-butanoyl]amino]-5-chloro-benzoic acid Formula: C18H17Cl2N3O4 MolecularWeight: 410.25128

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=C(C=C1)Cl)(C(=O)NC2=C(C=C(C=C2)Cl)C(=O)O)N

Isomeric SMILES

CC(CC(=O)NC1=CC=C(C=C1)Cl)(C(=O)NC2=C(C=C(C=C2)Cl)C(=O)O)N

InChI

InChI=1S/C18H17Cl2N3O4/c1-18(21,9-15(24)22-12-5-2-10(19)3-6-12)17(27)23-14-7-4-11(20)8-13(14)16(25)26/h2-8H,9,21H2,1H3,(H,22,24)(H,23,27)(H,25,26)