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

Systemtic Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C23H26ClN3O5S MolecularWeight: 491.98764

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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(C3CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC(C3CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H26ClN3O5S/c1-15-2-9-20(27(29)30)14-21(15)33(31,32)26-12-10-18(11-13-26)23(28)25-22(16-3-4-16)17-5-7-19(24)8-6-17/h2,5-9,14,16,18,22H,3-4,10-13H2,1H3,(H,25,28)