1-[2-fluoranyl-5-(4-methylpiperidin-1-yl)-4-nitro-phenyl]azepane

Systemtic Name: 1-[2-fluoranyl-5-(4-methylpiperidin-1-yl)-4-nitro-phenyl]azepane Openeye Name: 1-[2-fluoro-5-(4-methyl-1-piperidyl)-4-nitro-phenyl]azepane CAS Name: 1-[2-fluoro-5-(4-methyl-1-piperidinyl)-4-nitrophenyl]azepane IUPAC Name: 1-[2-fluoro-5-(4-methylpiperidin-1-yl)-4-nitrophenyl]azepane Traditional Name: 1-[2-fluoro-5-(4-methylpiperidino)-4-nitro-phenyl]azepane Formula: C18H26FN3O2 MolecularWeight: 335.416343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCCCC3

Isomeric SMILES

CC1CCN(CC1)C2=CC(=C(C=C2[N+](=O)[O-])F)N3CCCCCC3

InChI

InChI=1S/C18H26FN3O2/c1-14-6-10-21(11-7-14)17-13-16(15(19)12-18(17)22(23)24)20-8-4-2-3-5-9-20/h12-14H,2-11H2,1H3