1-(azepan-1-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione

Systemtic Name: 1-(azepan-1-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione Openeye Name: 1-(azepan-1-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione CAS Name: 1-(1-azepanyl)-5-[4-(2-methoxyphenyl)-1-piperazinyl]pentane-1,5-dione IUPAC Name: 1-(azepan-1-yl)-5-[4-(2-methoxyphenyl)piperazin-1-yl]pentane-1,5-dione Traditional Name: 1-(azepan-1-yl)-5-[4-(2-methoxyphenyl)piperazino]pentane-1,5-dione Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCC(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CCCC(=O)N3CCCCCC3

InChI

InChI=1S/C22H33N3O3/c1-28-20-10-5-4-9-19(20)23-15-17-25(18-16-23)22(27)12-8-11-21(26)24-13-6-2-3-7-14-24/h4-5,9-10H,2-3,6-8,11-18H2,1H3