N-ethyl-1-(2-nitrophenyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]methanesulfonamide

Systemtic Name: N-ethyl-1-(2-nitrophenyl)-N-[1-(phenylmethyl)pyrrolidin-3-yl]methanesulfonamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-ethyl-1-(2-nitrophenyl)-N-[1-(phenylmethyl)-3-pyrrolidinyl]methanesulfonamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-N-ethyl-1-(2-nitrophenyl)methanesulfonamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN(C1CCN(C1)CC2=CC=CC=C2)S(=O)(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O4S/c1-2-22(19-12-13-21(15-19)14-17-8-4-3-5-9-17)28(26,27)16-18-10-6-7-11-20(18)23(24)25/h3-11,19H,2,12-16H2,1H3