2-[(2-chlorophenyl)methylsulfonylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxylic acid

Systemtic Name: 2-[(2-chlorophenyl)methylsulfonylmethyl]-3-oxidanylidene-2,4-dihydro-1H-quinoxaline-6-carboxylic acid Openeye Name: 2-[(2-chlorophenyl)methylsulfonylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylic acid CAS Name: 2-[(2-chlorophenyl)methylsulfonylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylic acid IUPAC Name: 2-[(2-chlorophenyl)methylsulfonylmethyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxylic acid Traditional Name: 2-[(2-chlorobenzyl)sulfonylmethyl]-3-keto-2,4-dihydro-1H-quinoxaline-6-carboxylic acid Formula: C17H15ClN2O5S MolecularWeight: 394.8294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CS(=O)(=O)CC2C(=O)NC3=C(N2)C=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C17H15ClN2O5S/c18-12-4-2-1-3-11(12)8-26(24,25)9-15-16(21)20-14-7-10(17(22)23)5-6-13(14)19-15/h1-7,15,19H,8-9H2,(H,20,21)(H,22,23)