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

Systemtic Name: (3S)-3-[(2-chlorophenyl)amino]-4-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate Openeye Name: (3S)-3-(2-chloroanilino)-4-oxo-cyclohexa-1,5-diene-1-carboxylate CAS Name: (3S)-3-(2-chloroanilino)-4-oxo-1-cyclohexa-1,5-dienecarboxylate IUPAC Name: (3S)-3-(2-chloroanilino)-4-oxocyclohexa-1,5-diene-1-carboxylate Traditional Name: (3S)-3-(2-chloroanilino)-4-keto-cyclohexa-1,5-diene-1-carboxylate Formula: C13H9ClNO3- MolecularWeight: 262.66846

Click to see the large picture

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)/p-1/t11-/m0/s1