4-(azepan-1-yl)-N-[3,5-bis(fluoranyl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-[3,5-bis(fluoranyl)phenyl]-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-(3,5-difluorophenyl)-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-(3,5-difluorophenyl)-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-(3,5-difluorophenyl)-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-(3,5-difluorophenyl)-3-nitro-benzamide Formula: C19H19F2N3O3 MolecularWeight: 375.369266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19F2N3O3/c20-14-10-15(21)12-16(11-14)22-19(25)13-5-6-17(18(9-13)24(26)27)23-7-3-1-2-4-8-23/h5-6,9-12H,1-4,7-8H2,(H,22,25)