1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-piperidine

Systemtic Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-piperidine Openeye Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-piperidine CAS Name: 1-[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]-4-phenylpiperidine IUPAC Name: 1-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)-4-phenylpiperidine Traditional Name: 1-(4-nitro-2-pyrrolidinosulfonyl-phenyl)-4-phenyl-piperidine Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O4S/c25-24(26)19-8-9-20(21(16-19)29(27,28)23-12-4-5-13-23)22-14-10-18(11-15-22)17-6-2-1-3-7-17/h1-3,6-9,16,18H,4-5,10-15H2