2-[(phenylmethyl)amino]-5-(sulfinoamino)benzoic acid

Systemtic Name: 2-[(phenylmethyl)amino]-5-(sulfinoamino)benzoic acid Openeye Name: 2-(benzylamino)-5-(sulfinoamino)benzoic acid CAS Name: 2-[(phenylmethyl)amino]-5-(sulfinoamino)benzoic acid IUPAC Name: 2-(benzylamino)-5-(sulfinoamino)benzoic acid Traditional Name: 2-(benzylamino)-5-(sulfinoamino)benzoic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)NS(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C=C(C=C2)NS(=O)O)C(=O)O

InChI

InChI=1S/C14H14N2O4S/c17-14(18)12-8-11(16-21(19)20)6-7-13(12)15-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2,(H,17,18)(H,19,20)