(3S)-3-[(2-chlorophenyl)amino]-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylic acid

Systemtic Name: (3S)-3-[(2-chlorophenyl)amino]-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylic acid Openeye Name: (3S)-3-(2-chloroanilino)-4-oxo-cyclohexa-1,5-diene-1-carboxylic acid CAS Name: (3S)-3-(2-chloroanilino)-4-oxo-1-cyclohexa-1,5-dienecarboxylic acid IUPAC Name: (3S)-3-(2-chloroanilino)-4-oxocyclohexa-1,5-diene-1-carboxylic acid Traditional Name: (3S)-3-(2-chloroanilino)-4-keto-cyclohexa-1,5-diene-1-carboxylic acid Formula: C13H10ClNO3 MolecularWeight: 263.6764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2C=C(C=CC2=O)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N[C@H]2C=C(C=CC2=O)C(=O)O)Cl

InChI

InChI=1S/C13H10ClNO3/c14-9-3-1-2-4-10(9)15-11-7-8(13(17)18)5-6-12(11)16/h1-7,11,15H,(H,17,18)/t11-/m0/s1