N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-(difluoromethoxy)-4-methoxy-phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-[3-(difluoromethoxy)-4-methoxyphenyl]-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[3-(difluoromethoxy)-4-methoxyphenyl]-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[3-(difluoromethoxy)-4-methoxy-phenyl]-5-nitro-2-pyrrolidino-benzamide Formula: C19H19F2N3O5 MolecularWeight: 407.368066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)OC(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3)OC(F)F

InChI

InChI=1S/C19H19F2N3O5/c1-28-16-7-4-12(10-17(16)29-19(20)21)22-18(25)14-11-13(24(26)27)5-6-15(14)23-8-2-3-9-23/h4-7,10-11,19H,2-3,8-9H2,1H3,(H,22,25)