N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide CAS Name: N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenyl-1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: N-(cyclohexylmethyl)-4-nitro-N-[3-(4-phenylpiperazino)propyl]benzenesulfonamide Formula: C26H36N4O4S MolecularWeight: 500.65344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CN(CCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H36N4O4S/c31-30(32)25-12-14-26(15-13-25)35(33,34)29(22-23-8-3-1-4-9-23)17-7-16-27-18-20-28(21-19-27)24-10-5-2-6-11-24/h2,5-6,10-15,23H,1,3-4,7-9,16-22H2