1-(3-methylbutyl)-5-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]azepan-2-one

Systemtic Name: 1-(3-methylbutyl)-5-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]azepan-2-one Openeye Name: 1-isopentyl-5-(4-tetralin-2-ylpiperazin-1-yl)azepan-2-one CAS Name: 1-(3-methylbutyl)-5-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)-1-piperazinyl]-2-azepanone IUPAC Name: 1-(3-methylbutyl)-5-[4-(1,2,3,4-tetrahydronaphthalen-2-yl)piperazin-1-yl]azepan-2-one Traditional Name: 1-isoamyl-5-(4-tetralin-2-ylpiperazino)azepan-2-one Formula: C25H39N3O MolecularWeight: 397.59666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CCC(CCC1=O)N2CCN(CC2)C3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CCN1CCC(CCC1=O)N2CCN(CC2)C3CCC4=CC=CC=C4C3

InChI

InChI=1S/C25H39N3O/c1-20(2)11-13-28-14-12-23(9-10-25(28)29)26-15-17-27(18-16-26)24-8-7-21-5-3-4-6-22(21)19-24/h3-6,20,23-24H,7-19H2,1-2H3