azepan-1-yl-[1-(1-phenethylpiperidin-4-yl)piperidin-3-yl]methanone

Systemtic Name: azepan-1-yl-[1-(1-phenethylpiperidin-4-yl)piperidin-3-yl]methanone Openeye Name: azepan-1-yl-[1-(1-phenethyl-4-piperidyl)-3-piperidyl]methanone CAS Name: 1-azepanyl-[1-(1-phenethyl-4-piperidinyl)-3-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(1-phenethylpiperidin-4-yl)piperidin-3-yl]methanone Traditional Name: azepan-1-yl-[1-(1-phenethyl-4-piperidyl)-3-piperidyl]methanone Formula: C25H39N3O MolecularWeight: 397.59666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCN(C2)C3CCN(CC3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCCN(C2)C3CCN(CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C25H39N3O/c29-25(27-15-6-1-2-7-16-27)23-11-8-17-28(21-23)24-13-19-26(20-14-24)18-12-22-9-4-3-5-10-22/h3-5,9-10,23-24H,1-2,6-8,11-21H2