4-[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-3-nitro-benzamide

Systemtic Name: 4-[[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-3-nitro-benzamide Openeye Name: 4-[[2-(3-fluoroanilino)-2-oxo-ethyl]-methyl-amino]-3-nitro-benzamide CAS Name: 4-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-3-nitrobenzamide IUPAC Name: 4-[[2-(3-fluoroanilino)-2-oxoethyl]-methylamino]-3-nitrobenzamide Traditional Name: 4-[[2-(3-fluoroanilino)-2-keto-ethyl]-methyl-amino]-3-nitro-benzamide Formula: C16H15FN4O4 MolecularWeight: 346.313103

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=CC=C1)F)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)NC1=CC(=CC=C1)F)C2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H15FN4O4/c1-20(9-15(22)19-12-4-2-3-11(17)8-12)13-6-5-10(16(18)23)7-14(13)21(24)25/h2-8H,9H2,1H3,(H2,18,23)(H,19,22)