N-methyl-4-nitro-N-[4-(4-piperidin-1-ylbutoxy)cyclohexyl]benzenesulfonamide

Systemtic Name: N-methyl-4-nitro-N-[4-(4-piperidin-1-ylbutoxy)cyclohexyl]benzenesulfonamide Openeye Name: N-methyl-4-nitro-N-[4-[4-(1-piperidyl)butoxy]cyclohexyl]benzenesulfonamide CAS Name: N-methyl-4-nitro-N-[4-[4-(1-piperidinyl)butoxy]cyclohexyl]benzenesulfonamide IUPAC Name: N-methyl-4-nitro-N-[4-(4-piperidin-1-ylbutoxy)cyclohexyl]benzenesulfonamide Traditional Name: N-methyl-4-nitro-N-[4-(4-piperidinobutoxy)cyclohexyl]benzenesulfonamide Formula: C22H35N3O5S MolecularWeight: 453.5954

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC(CC1)OCCCCN2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCC(CC1)OCCCCN2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H35N3O5S/c1-23(31(28,29)22-13-9-20(10-14-22)25(26)27)19-7-11-21(12-8-19)30-18-6-5-17-24-15-3-2-4-16-24/h9-10,13-14,19,21H,2-8,11-12,15-18H2,1H3