2-azanyl-3-(phenylmethyl)sulfonyl-benzoic acid

Systemtic Name: 2-azanyl-3-(phenylmethyl)sulfonyl-benzoic acid Openeye Name: 2-amino-3-benzylsulfonyl-benzoic acid CAS Name: 2-amino-3-(phenylmethyl)sulfonylbenzoic acid IUPAC Name: 2-amino-3-benzylsulfonylbenzoic acid Traditional Name: 2-amino-3-benzylsulfonyl-benzoic acid Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=CC(=C2N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C2=CC=CC(=C2N)C(=O)O

InChI

InChI=1S/C14H13NO4S/c15-13-11(14(16)17)7-4-8-12(13)20(18,19)9-10-5-2-1-3-6-10/h1-8H,9,15H2,(H,16,17)