5-nitro-2-[(phenylmethyl)sulfonylamino]benzoic acid

Systemtic Name: 5-nitro-2-[(phenylmethyl)sulfonylamino]benzoic acid Openeye Name: 2-(benzylsulfonylamino)-5-nitro-benzoic acid CAS Name: 5-nitro-2-[(phenylmethyl)sulfonylamino]benzoic acid IUPAC Name: 2-(benzylsulfonylamino)-5-nitrobenzoic acid Traditional Name: 2-(benzylsulfonylamino)-5-nitro-benzoic acid Formula: C14H12N2O6S MolecularWeight: 336.31988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H12N2O6S/c17-14(18)12-8-11(16(19)20)6-7-13(12)15-23(21,22)9-10-4-2-1-3-5-10/h1-8,15H,9H2,(H,17,18)