1-[[(3-carboxy-4-oxidanyl-phenoxy)amino]-sulfinato-amino]-2-methoxy-4-phenylazanyl-benzene

Systemtic Name: 1-[[(3-carboxy-4-oxidanyl-phenoxy)amino]-sulfinato-amino]-2-methoxy-4-phenylazanyl-benzene Openeye Name: 4-anilino-1-[[(3-carboxy-4-hydroxy-phenoxy)amino]-sulfinato-amino]-2-methoxy-benzene CAS Name: 4-anilino-1-[[(3-carboxy-4-hydroxyphenoxy)amino]-sulfinatoamino]-2-methoxybenzene IUPAC Name: 4-anilino-1-[[(3-carboxy-4-hydroxyphenoxy)amino]-sulfinatoamino]-2-methoxybenzene Traditional Name: 4-anilino-1-[[(3-carboxy-4-hydroxy-phenoxy)amino]-sulfinato-amino]-2-methoxy-benzene Formula: C20H18N3O7S- MolecularWeight: 444.43782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=CC=CC=C2)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=CC=CC=C2)N(NOC3=CC(=C(C=C3)O)C(=O)O)S(=O)[O-]

InChI

InChI=1S/C20H19N3O7S/c1-29-19-11-14(21-13-5-3-2-4-6-13)7-9-17(19)23(31(27)28)22-30-15-8-10-18(24)16(12-15)20(25)26/h2-12,21-22,24H,1H3,(H,25,26)(H,27,28)/p-1