[(3R)-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]piperidin-3-yl]methanol

Systemtic Name: [(3R)-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-2-nitro-phenyl]piperidin-3-yl]methanol Openeye Name: [(3R)-1-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]-2-nitro-phenyl]-3-piperidyl]methanol CAS Name: [(3R)-1-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]-2-nitrophenyl]-3-piperidinyl]methanol IUPAC Name: [(3R)-1-[4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-2-nitrophenyl]piperidin-3-yl]methanol Traditional Name: [(3R)-1-[4-[(3S)-3-methylpiperidino]sulfonyl-2-nitro-phenyl]-3-piperidyl]methanol Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC(C3)CO)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC[C@H](C3)CO)[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O5S/c1-14-4-2-9-20(11-14)27(25,26)16-6-7-17(18(10-16)21(23)24)19-8-3-5-15(12-19)13-22/h6-7,10,14-15,22H,2-5,8-9,11-13H2,1H3/t14-,15+/m0/s1