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

Systemtic Name: (R)-[1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperidin-4-yl]-phenyl-methanol Openeye Name: (R)-[1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-4-piperidyl]-phenyl-methanol CAS Name: (R)-[1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-4-piperidinyl]-phenylmethanol IUPAC Name: (R)-[1-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperidin-4-yl]-phenylmethanol Traditional Name: (R)-[1-(2-nitro-4-piperidinosulfonyl-phenyl)-4-piperidyl]-phenyl-methanol Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(C4=CC=CC=C4)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)[C@H](C4=CC=CC=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O5S/c27-23(18-7-3-1-4-8-18)19-11-15-24(16-12-19)21-10-9-20(17-22(21)26(28)29)32(30,31)25-13-5-2-6-14-25/h1,3-4,7-10,17,19,23,27H,2,5-6,11-16H2/t23-/m0/s1