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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCC(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCC(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

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