sodium 4-[(phenylmethyl)-(phenylsulfonyl)amino]benzoate

Systemtic Name: sodium 4-[(phenylmethyl)-(phenylsulfonyl)amino]benzoate Openeye Name: sodium 4-[benzenesulfonyl(benzyl)amino]benzoate CAS Name: sodium 4-[benzenesulfonyl-(phenylmethyl)amino]benzoate IUPAC Name: sodium 4-[benzenesulfonyl(benzyl)amino]benzoate Traditional Name: sodium 4-[benzyl(besyl)amino]benzoate Formula: C20H16NNaO4S MolecularWeight: 389.40011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)C3=CC=CC=C3.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)[O-])S(=O)(=O)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C20H17NO4S.Na/c22-20(23)17-11-13-18(14-12-17)21(15-16-7-3-1-4-8-16)26(24,25)19-9-5-2-6-10-19;/h1-14H,15H2,(H,22,23);/q;+1/p-1