4-(azepan-1-yl)-N-(4-fluoranyl-3-nitro-phenyl)-3-nitro-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-(4-fluoranyl-3-nitro-phenyl)-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-(4-fluoro-3-nitro-phenyl)-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-(4-fluoro-3-nitrophenyl)-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-(4-fluoro-3-nitrophenyl)-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-(4-fluoro-3-nitro-phenyl)-3-nitro-benzamide Formula: C19H19FN4O5 MolecularWeight: 402.376363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H19FN4O5/c20-15-7-6-14(12-17(15)23(26)27)21-19(25)13-5-8-16(18(11-13)24(28)29)22-9-3-1-2-4-10-22/h5-8,11-12H,1-4,9-10H2,(H,21,25)