1-cyclohexyl-N-[4-[4-(3-nitrophenyl)piperazin-1-yl]butyl]methanesulfonamide

Systemtic Name: 1-cyclohexyl-N-[4-[4-(3-nitrophenyl)piperazin-1-yl]butyl]methanesulfonamide Openeye Name: 1-cyclohexyl-N-[4-[4-(3-nitrophenyl)piperazin-1-yl]butyl]methanesulfonamide CAS Name: 1-cyclohexyl-N-[4-[4-(3-nitrophenyl)-1-piperazinyl]butyl]methanesulfonamide IUPAC Name: 1-cyclohexyl-N-[4-[4-(3-nitrophenyl)piperazin-1-yl]butyl]methanesulfonamide Traditional Name: 1-cyclohexyl-N-[4-[4-(3-nitrophenyl)piperazino]butyl]methanesulfonamide Formula: C21H34N4O4S MolecularWeight: 438.58406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CS(=O)(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CS(=O)(=O)NCCCCN2CCN(CC2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H34N4O4S/c26-25(27)21-10-6-9-20(17-21)24-15-13-23(14-16-24)12-5-4-11-22-30(28,29)18-19-7-2-1-3-8-19/h6,9-10,17,19,22H,1-5,7-8,11-16,18H2