2-[(3-azanyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: 2-[(3-azanyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethanesulfonic acid Openeye Name: 2-(3-amino-4-methoxy-anilino)-2-oxo-ethanesulfonic acid CAS Name: 2-(3-amino-4-methoxyanilino)-2-oxoethanesulfonic acid IUPAC Name: 2-(3-amino-4-methoxyanilino)-2-oxoethanesulfonic acid Traditional Name: 2-(3-amino-4-methoxy-anilino)-2-keto-ethanesulfonic acid Formula: C9H12N2O5S MolecularWeight: 260.26698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)O)N

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CS(=O)(=O)O)N

InChI

InChI=1S/C9H12N2O5S/c1-16-8-3-2-6(4-7(8)10)11-9(12)5-17(13,14)15/h2-4H,5,10H2,1H3,(H,11,12)(H,13,14,15)