(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)pyrrolidine-2-carboxamide

Systemtic Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)pyrrolidine-2-carboxamide Openeye Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)pyrrolidine-2-carboxamide CAS Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitrophenyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitrophenyl)pyrrolidine-2-carboxamide Traditional Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-(4-methyl-3-nitro-phenyl)pyrrolidine-2-carboxamide Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H]2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O7S/c1-13-4-5-14(11-17(13)23(25)26)21-20(24)16-3-2-8-22(16)31(27,28)15-6-7-18-19(12-15)30-10-9-29-18/h4-7,11-12,16H,2-3,8-10H2,1H3,(H,21,24)/t16-/m1/s1