1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-methylpropanoyl)-4-piperidyl]piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[1-(2-methylpropanoyl)piperidin-4-yl]piperidine-4-carboxamide Traditional Name: N-(1-isobutyryl-4-piperidyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C22H32N4O6S MolecularWeight: 480.57768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C22H32N4O6S/c1-15(2)22(28)24-10-8-18(9-11-24)23-21(27)17-6-12-25(13-7-17)33(31,32)20-14-19(26(29)30)5-4-16(20)3/h4-5,14-15,17-18H,6-13H2,1-3H3,(H,23,27)