1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-5-keto-pyrrolidine-3-carboxamide Formula: C21H21N3O7 MolecularWeight: 427.40734

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)NCC(C4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)N3CC(CC3=O)C(=O)NCC(C4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C21H21N3O7/c25-17(13-1-3-15(4-2-13)24(28)29)11-22-21(27)14-9-20(26)23(12-14)16-5-6-18-19(10-16)31-8-7-30-18/h1-6,10,14,17,25H,7-9,11-12H2,(H,22,27)