4-azanyl-7-methoxycarbonyl-3-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 4-azanyl-7-methoxycarbonyl-3-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 4-amino-3-hydroxy-7-methoxycarbonyl-naphthalene-1-sulfonic acid CAS Name: 4-amino-3-hydroxy-7-methoxycarbonyl-1-naphthalenesulfonic acid IUPAC Name: 4-amino-3-hydroxy-7-methoxycarbonylnaphthalene-1-sulfonic acid Traditional Name: 4-amino-7-carbomethoxy-3-hydroxy-naphthalene-1-sulfonic acid Formula: C12H11NO6S MolecularWeight: 297.28384

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C(C(=C2C=C1)N)O)S(=O)(=O)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C(C(=C2C=C1)N)O)S(=O)(=O)O

InChI

InChI=1S/C12H11NO6S/c1-19-12(15)6-2-3-7-8(4-6)10(20(16,17)18)5-9(14)11(7)13/h2-5,14H,13H2,1H3,(H,16,17,18)