1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-3,6-dihydro-2H-pyridine

Systemtic Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-3,6-dihydro-2H-pyridine Openeye Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)-4-phenyl-3,6-dihydro-2H-pyridine CAS Name: 1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-4-phenyl-3,6-dihydro-2H-pyridine IUPAC Name: 1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)-4-phenyl-3,6-dihydro-2H-pyridine Traditional Name: 1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)-4-phenyl-3,6-dihydro-2H-pyridine Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c25-24(26)21-16-19(29(27,28)23-12-4-5-13-23)8-9-20(21)22-14-10-18(11-15-22)17-6-2-1-3-7-17/h1-3,6-10,16H,4-5,11-15H2