4-[2-[[2-carboxy-4-(sulfinatoamino)phenyl]amino]ethyl]-1,2-dimethoxy-benzene

Systemtic Name: 4-[2-[[2-carboxy-4-(sulfinatoamino)phenyl]amino]ethyl]-1,2-dimethoxy-benzene Openeye Name: 4-[2-[2-carboxy-4-(sulfinatoamino)anilino]ethyl]-1,2-dimethoxy-benzene CAS Name: 4-[2-[2-carboxy-4-(sulfinatoamino)anilino]ethyl]-1,2-dimethoxybenzene IUPAC Name: 4-[2-[2-carboxy-4-(sulfinatoamino)anilino]ethyl]-1,2-dimethoxybenzene Traditional Name: 4-[2-[2-carboxy-4-(sulfinatoamino)anilino]ethyl]-1,2-dimethoxy-benzene Formula: C17H19N2O6S- MolecularWeight: 379.40756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)NS(=O)[O-])C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)NS(=O)[O-])C(=O)O)OC

InChI

InChI=1S/C17H20N2O6S/c1-24-15-6-3-11(9-16(15)25-2)7-8-18-14-5-4-12(19-26(22)23)10-13(14)17(20)21/h3-6,9-10,18-19H,7-8H2,1-2H3,(H,20,21)(H,22,23)/p-1