1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-[4-(2-methylpropyl)phenyl]ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-[4-(2-methylpropyl)phenyl]ethyl]piperidine-4-carboxamide Openeye Name: N-[1-(4-isobutylphenyl)ethyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[1-[4-(2-methylpropyl)phenyl]ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-[1-[4-(2-methylpropyl)phenyl]ethyl]piperidine-4-carboxamide Traditional Name: N-[1-(4-isobutylphenyl)ethyl]-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)NC(C)C3=CC=C(C=C3)CC(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=C(C=C3)CC(C)C

InChI

InChI=1S/C25H33N3O5S/c1-17(2)15-20-6-8-21(9-7-20)19(4)26-25(29)22-11-13-27(14-12-22)34(32,33)24-16-23(28(30)31)10-5-18(24)3/h5-10,16-17,19,22H,11-15H2,1-4H3,(H,26,29)