azepan-1-yl-[1-[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[6-(3-bromophenyl)-2-methyl-pyridine-3-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[6-(3-bromophenyl)-2-methyl-3-pyridinyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[6-(3-bromophenyl)-2-methylpyridine-3-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[6-(3-bromophenyl)-2-methyl-nicotinoyl]-4-piperidyl]methanone Formula: C25H30BrN3O2 MolecularWeight: 484.4286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H30BrN3O2/c1-18-22(9-10-23(27-18)20-7-6-8-21(26)17-20)25(31)29-15-11-19(12-16-29)24(30)28-13-4-2-3-5-14-28/h6-10,17,19H,2-5,11-16H2,1H3