4-[3-[[butan-2-yl(methyl)amino]methyl]phenyl]-1-(4-nitrophenyl)sulfonyl-piperidin-4-ol

Systemtic Name: 4-[3-[[butan-2-yl(methyl)amino]methyl]phenyl]-1-(4-nitrophenyl)sulfonyl-piperidin-4-ol Openeye Name: 4-[3-[[methyl(sec-butyl)amino]methyl]phenyl]-1-(4-nitrophenyl)sulfonyl-piperidin-4-ol CAS Name: 4-[3-[[butan-2-yl(methyl)amino]methyl]phenyl]-1-(4-nitrophenyl)sulfonyl-4-piperidinol IUPAC Name: 4-[3-[[butan-2-yl(methyl)amino]methyl]phenyl]-1-(4-nitrophenyl)sulfonylpiperidin-4-ol Traditional Name: 4-[3-[[methyl(sec-butyl)amino]methyl]phenyl]-1-nosyl-piperidin-4-ol Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C)CC1=CC=CC(=C1)C2(CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CCC(C)N(C)CC1=CC=CC(=C1)C2(CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C23H31N3O5S/c1-4-18(2)24(3)17-19-6-5-7-20(16-19)23(27)12-14-25(15-13-23)32(30,31)22-10-8-21(9-11-22)26(28)29/h5-11,16,18,27H,4,12-15,17H2,1-3H3