3-azanyl-5-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoic acid hydrochloride

Systemtic Name: 3-azanyl-5-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoic acid hydrochloride Openeye Name: 3-amino-5-(2-benzoyl-4-chloro-anilino)-3-methyl-5-oxo-pentanoic acid hydrochloride CAS Name: 3-amino-5-(2-benzoyl-4-chloroanilino)-3-methyl-5-oxopentanoic acid hydrochloride IUPAC Name: 3-amino-5-(2-benzoyl-4-chloroanilino)-3-methyl-5-oxopentanoic acid hydrochloride Traditional Name: 3-amino-5-(2-benzoyl-4-chloro-anilino)-5-keto-3-methyl-valeric acid hydrochloride Formula: C19H20Cl2N2O4 MolecularWeight: 411.2791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN2O4.ClH/c1-19(21,11-17(24)25)10-16(23)22-15-8-7-13(20)9-14(15)18(26)12-5-3-2-4-6-12;/h2-9H,10-11,21H2,1H3,(H,22,23)(H,24,25);1H