1-[3-nitro-4-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]phenyl]sulfonylpiperidine

Systemtic Name: 1-[3-nitro-4-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]phenyl]sulfonylpiperidine Openeye Name: 1-[3-nitro-4-[(2R)-2-(2-thienyl)pyrrolidin-1-yl]phenyl]sulfonylpiperidine CAS Name: 1-[3-nitro-4-[(2R)-2-thiophen-2-yl-1-pyrrolidinyl]phenyl]sulfonylpiperidine IUPAC Name: 1-[3-nitro-4-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]phenyl]sulfonylpiperidine Traditional Name: 1-[3-nitro-4-[(2R)-2-(2-thienyl)pyrrolidino]phenyl]sulfonylpiperidine Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC[C@@H]3C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4S2/c23-22(24)18-14-15(28(25,26)20-10-2-1-3-11-20)8-9-16(18)21-12-4-6-17(21)19-7-5-13-27-19/h5,7-9,13-14,17H,1-4,6,10-12H2/t17-/m1/s1