N-[2-[di(propan-2-yl)amino]ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C21H34N4O5S MolecularWeight: 454.58346

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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)NCCN(C(C)C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H34N4O5S/c1-15(2)24(16(3)4)13-10-22-21(26)18-8-11-23(12-9-18)31(29,30)20-14-19(25(27)28)7-6-17(20)5/h6-7,14-16,18H,8-13H2,1-5H3,(H,22,26)