[(3R)-1-(2-nitrophenyl)sulfonylpiperidin-3-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone

Systemtic Name: [(3R)-1-(2-nitrophenyl)sulfonylpiperidin-3-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone Openeye Name: [(3R)-1-(2-nitrophenyl)sulfonyl-3-piperidyl]-[3-(3-pyridyl)pyrrolidin-1-yl]methanone CAS Name: [(3R)-1-(2-nitrophenyl)sulfonyl-3-piperidinyl]-[3-(3-pyridinyl)-1-pyrrolidinyl]methanone IUPAC Name: [(3R)-1-(2-nitrophenyl)sulfonylpiperidin-3-yl]-(3-pyridin-3-ylpyrrolidin-1-yl)methanone Traditional Name: [(3R)-1-(2-nitrophenyl)sulfonyl-3-piperidyl]-[3-(3-pyridyl)pyrrolidino]methanone Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCC(C3)C4=CN=CC=C4

Isomeric SMILES

C1C[C@H](CN(C1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(=O)N3CCC(C3)C4=CN=CC=C4

InChI

InChI=1S/C21H24N4O5S/c26-21(23-12-9-17(14-23)16-5-3-10-22-13-16)18-6-4-11-24(15-18)31(29,30)20-8-2-1-7-19(20)25(27)28/h1-3,5,7-8,10,13,17-18H,4,6,9,11-12,14-15H2/t17?,18-/m1/s1