N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-cyclopropane-1-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-cyclopropane-1-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-nitro-cyclopropanecarboxamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-nitro-1-cyclopropanecarboxamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-nitrocyclopropane-1-carboxamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-2-nitro-cyclopropanecarboxamide Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2CC2[N+](=O)[O-])N3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2CC2[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C17H23N3O4/c1-24-13-6-4-5-12(9-13)16(19-7-2-3-8-19)11-18-17(21)14-10-15(14)20(22)23/h4-6,9,14-16H,2-3,7-8,10-11H2,1H3,(H,18,21)