1-(azepan-1-yl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethoxy]ethanone CAS Name: 1-(1-azepanyl)-2-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethoxy]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethoxy]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethoxy]ethanone Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O4/c1-27-19-9-5-4-8-18(19)22-12-14-24(15-13-22)21(26)17-28-16-20(25)23-10-6-2-3-7-11-23/h4-5,8-9H,2-3,6-7,10-17H2,1H3