2-nitro-N-phenyl-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-phenyl-N-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]benzenesulfonamide Openeye Name: N-[3-(4-benzyl-1-piperidyl)propyl]-2-nitro-N-phenyl-benzenesulfonamide CAS Name: 2-nitro-N-phenyl-N-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]benzenesulfonamide IUPAC Name: N-[3-(4-benzylpiperidin-1-yl)propyl]-2-nitro-N-phenylbenzenesulfonamide Traditional Name: N-[3-(4-benzylpiperidino)propyl]-2-nitro-N-phenyl-benzenesulfonamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCN(C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCN(C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H31N3O4S/c31-30(32)26-14-7-8-15-27(26)35(33,34)29(25-12-5-2-6-13-25)19-9-18-28-20-16-24(17-21-28)22-23-10-3-1-4-11-23/h1-8,10-15,24H,9,16-22H2