azepan-1-yl-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: azepan-1-yl-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone Openeye Name: azepan-1-yl-[4-(4-methyl-1-piperidyl)-3-nitro-phenyl]methanone CAS Name: 1-azepanyl-[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]methanone IUPAC Name: azepan-1-yl-[4-(4-methylpiperidin-1-yl)-3-nitrophenyl]methanone Traditional Name: azepan-1-yl-[4-(4-methylpiperidino)-3-nitro-phenyl]methanone Formula: C19H27N3O3 MolecularWeight: 345.43598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O3/c1-15-8-12-20(13-9-15)17-7-6-16(14-18(17)22(24)25)19(23)21-10-4-2-3-5-11-21/h6-7,14-15H,2-5,8-13H2,1H3