N-[2,6-di(propan-2-yl)phenyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,6-diisopropylphenyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,6-diisopropylphenyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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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)NC3=C(C=CC=C3C(C)C)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC=C3C(C)C)C(C)C

InChI

InChI=1S/C25H33N3O5S/c1-16(2)21-7-6-8-22(17(3)4)24(21)26-25(29)19-11-13-27(14-12-19)34(32,33)23-15-20(28(30)31)10-9-18(23)5/h6-10,15-17,19H,11-14H2,1-5H3,(H,26,29)