[(1R,2S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-1-phenyl-butyl] nitrate

Systemtic Name: [(1R,2S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-1-phenyl-butyl] nitrate Openeye Name: [(1R,2S)-3-hydroxy-1-phenyl-2-(p-tolylsulfonylamino)butyl] nitrate CAS Name: nitric acid [(1R,2S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-1-phenylbutyl] ester IUPAC Name: [(1R,2S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-1-phenylbutyl] nitrate Traditional Name: nitric acid [(1R,2S)-3-hydroxy-1-phenyl-2-(tosylamino)butyl] ester Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)O)C(C2=CC=CC=C2)O[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H]([C@@H](C2=CC=CC=C2)O[N+](=O)[O-])C(C)O

InChI

InChI=1S/C17H20N2O6S/c1-12-8-10-15(11-9-12)26(23,24)18-16(13(2)20)17(25-19(21)22)14-6-4-3-5-7-14/h3-11,13,16-18,20H,1-2H3/t13?,16-,17+/m0/s1