3-[(4-nitrosonaphthalen-1-yl)amino]propane-1-sulfonate

Systemtic Name: 3-[(4-nitrosonaphthalen-1-yl)amino]propane-1-sulfonate Openeye Name: 3-[(4-nitroso-1-naphthyl)amino]propane-1-sulfonate CAS Name: 3-[(4-nitroso-1-naphthalenyl)amino]-1-propanesulfonate IUPAC Name: 3-[(4-nitrosonaphthalen-1-yl)amino]propane-1-sulfonate Traditional Name: 3-[(4-nitroso-1-naphthyl)amino]propane-1-sulfonate Formula: C13H13N2O4S- MolecularWeight: 293.31832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2N=O)NCCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2N=O)NCCCS(=O)(=O)[O-]

InChI

InChI=1S/C13H14N2O4S/c16-15-13-7-6-12(10-4-1-2-5-11(10)13)14-8-3-9-20(17,18)19/h1-2,4-7,14H,3,8-9H2,(H,17,18,19)/p-1