[(3R)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidin-3-yl]methanol

Systemtic Name: [(3R)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidin-3-yl]methanol Openeye Name: [(3R)-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-3-piperidyl]methanol CAS Name: [(3R)-1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-3-piperidinyl]methanol IUPAC Name: [(3R)-1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperidin-3-yl]methanol Traditional Name: [(3R)-1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)-3-piperidyl]methanol Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)CO)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC[C@H](C3)CO)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5S/c20-12-13-4-3-7-17(11-13)15-6-5-14(10-16(15)19(21)22)25(23,24)18-8-1-2-9-18/h5-6,10,13,20H,1-4,7-9,11-12H2/t13-/m1/s1