N-[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[1-[(3-methoxy-2-nitro-phenyl)methyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide CAS Name: N-[1-[(3-methoxy-2-nitrophenyl)methyl]-3-pyrrolidinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[1-[(3-methoxy-2-nitrophenyl)methyl]pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[1-(3-methoxy-2-nitro-benzyl)pyrrolidin-3-yl]-3-(trifluoromethyl)benzamide Formula: C20H20F3N3O4 MolecularWeight: 423.38571

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1[N+](=O)[O-])CN2CCC(C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1[N+](=O)[O-])CN2CCC(C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O4/c1-30-17-7-3-5-14(18(17)26(28)29)11-25-9-8-16(12-25)24-19(27)13-4-2-6-15(10-13)20(21,22)23/h2-7,10,16H,8-9,11-12H2,1H3,(H,24,27)