N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[2-[[2,6-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl]-N-ethyl-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[2-(2,6-difluoroanilino)-2-oxo-ethyl]-N-ethyl-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[2-(2,6-difluoroanilino)-2-keto-ethyl]-N-ethyl-3-nitro-4-pyrrolidino-benzamide Formula: C21H22F2N4O4 MolecularWeight: 432.420586

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC=C1F)F)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC=C1F)F)C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H22F2N4O4/c1-2-25(13-19(28)24-20-15(22)6-5-7-16(20)23)21(29)14-8-9-17(18(12-14)27(30)31)26-10-3-4-11-26/h5-9,12H,2-4,10-11,13H2,1H3,(H,24,28)