2-[4-(3-chloranyl-4,5-dimethoxy-phenyl)carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(3-chloranyl-4,5-dimethoxy-phenyl)carbonylpiperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-(3-chloro-4,5-dimethoxy-benzoyl)piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(3-chloro-4,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-(3-chloro-4,5-dimethoxybenzoyl)piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-(3-chloro-4,5-dimethoxy-benzoyl)piperazino]-1-piperidino-ethanone Formula: C20H28ClN3O4 MolecularWeight: 409.90702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC(=O)N3CCCCC3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)CC(=O)N3CCCCC3)Cl)OC

InChI

InChI=1S/C20H28ClN3O4/c1-27-17-13-15(12-16(21)19(17)28-2)20(26)24-10-8-22(9-11-24)14-18(25)23-6-4-3-5-7-23/h12-13H,3-11,14H2,1-2H3