2-carboxy-1-[(phenylmethyl)amino]-4-(sulfinatoamino)benzene

Systemtic Name: 2-carboxy-1-[(phenylmethyl)amino]-4-(sulfinatoamino)benzene Openeye Name: 1-(benzylamino)-2-carboxy-4-(sulfinatoamino)benzene CAS Name: 2-carboxy-1-[(phenylmethyl)amino]-4-(sulfinatoamino)benzene IUPAC Name: 1-(benzylamino)-2-carboxy-4-(sulfinatoamino)benzene Traditional Name: 1-(benzylamino)-2-carboxy-4-(sulfinatoamino)benzene Formula: C14H13N2O4S- MolecularWeight: 305.32902

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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)/p-1