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

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[4-(phenylmethyl)piperidin-1-yl]propyl]benzenesulfonamide Openeye Name: N-[3-(4-benzyl-1-piperidyl)-3-oxo-propyl]-4-nitro-benzenesulfonamide CAS Name: 4-nitro-N-[3-oxo-3-[4-(phenylmethyl)-1-piperidinyl]propyl]benzenesulfonamide IUPAC Name: N-[3-(4-benzylpiperidin-1-yl)-3-oxopropyl]-4-nitrobenzenesulfonamide Traditional Name: N-[3-(4-benzylpiperidino)-3-keto-propyl]-4-nitro-benzenesulfonamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CCNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5S/c25-21(23-14-11-18(12-15-23)16-17-4-2-1-3-5-17)10-13-22-30(28,29)20-8-6-19(7-9-20)24(26)27/h1-9,18,22H,10-16H2