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

Systemtic Name: (S)-[1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-phenyl]piperidin-4-yl]-phenyl-methanol Openeye Name: (S)-[1-[4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-phenyl]-4-piperidyl]-phenyl-methanol CAS Name: (S)-[1-[4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitrophenyl]-4-piperidinyl]-phenylmethanol IUPAC Name: (S)-[1-[4-(4-methylpiperidin-1-yl)sulfonyl-2-nitrophenyl]piperidin-4-yl]-phenylmethanol Traditional Name: (S)-[1-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]-4-piperidyl]-phenyl-methanol Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(C4=CC=CC=C4)O)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)[C@@H](C4=CC=CC=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C24H31N3O5S/c1-18-9-15-26(16-10-18)33(31,32)21-7-8-22(23(17-21)27(29)30)25-13-11-20(12-14-25)24(28)19-5-3-2-4-6-19/h2-8,17-18,20,24,28H,9-16H2,1H3/t24-/m1/s1