1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(2,3,4-trimethoxyphenyl)ethanone

Systemtic Name: 1-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]-2-(2,3,4-trimethoxyphenyl)ethanone Openeye Name: 1-[4-(azepane-1-carbonyl)-1-piperidyl]-2-(2,3,4-trimethoxyphenyl)ethanone CAS Name: 1-[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-2-(2,3,4-trimethoxyphenyl)ethanone IUPAC Name: 1-[4-(azepane-1-carbonyl)piperidin-1-yl]-2-(2,3,4-trimethoxyphenyl)ethanone Traditional Name: 1-[4-(azepane-1-carbonyl)piperidino]-2-(2,3,4-trimethoxyphenyl)ethanone Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(=O)N2CCC(CC2)C(=O)N3CCCCCC3)OC)OC

InChI

InChI=1S/C23H34N2O5/c1-28-19-9-8-18(21(29-2)22(19)30-3)16-20(26)24-14-10-17(11-15-24)23(27)25-12-6-4-5-7-13-25/h8-9,17H,4-7,10-16H2,1-3H3