4-[(2-chloranyl-3-oxidanylidene-butanoyl)amino]benzoic acid

Systemtic Name: 4-[(2-chloranyl-3-oxidanylidene-butanoyl)amino]benzoic acid Openeye Name: 4-[(2-chloro-3-oxo-butanoyl)amino]benzoic acid CAS Name: 4-[(2-chloro-1,3-dioxobutyl)amino]benzoic acid IUPAC Name: 4-[(2-chloro-3-oxobutanoyl)amino]benzoic acid Traditional Name: 4-[(2-chloro-3-keto-butanoyl)amino]benzoic acid Formula: C11H10ClNO4 MolecularWeight: 255.6544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)NC1=CC=C(C=C1)C(=O)O)Cl

Isomeric SMILES

CC(=O)C(C(=O)NC1=CC=C(C=C1)C(=O)O)Cl

InChI

InChI=1S/C11H10ClNO4/c1-6(14)9(12)10(15)13-8-4-2-7(3-5-8)11(16)17/h2-5,9H,1H3,(H,13,15)(H,16,17)