2-nitro-1-oxidanyl-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid

Systemtic Name: 2-nitro-1-oxidanyl-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid Openeye Name: 1-hydroxy-2-nitro-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid CAS Name: 1-hydroxy-2-nitro-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid IUPAC Name: 1-hydroxy-2-nitro-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid Traditional Name: 1-hydroxy-2-nitro-5-(sulfinatoamino)naphthalene; phenylmethanesulfonic acid Formula: C17H15N2O8S2- MolecularWeight: 439.4396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)O.C1=CC2=C(C=CC(=C2O)[N+](=O)[O-])C(=C1)NS(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)O.C1=CC2=C(C=CC(=C2O)[N+](=O)[O-])C(=C1)NS(=O)[O-]

InChI

InChI=1S/C10H8N2O5S.C7H8O3S/c13-10-7-2-1-3-8(11-18(16)17)6(7)4-5-9(10)12(14)15;8-11(9,10)6-7-4-2-1-3-5-7/h1-5,11,13H,(H,16,17);1-5H,6H2,(H,8,9,10)/p-1