2-(4-chloranylphenoxy)-1-[4-[3-(4-cyclohexylpiperazin-1-yl)carbonyl-6-methyl-pyridin-2-yl]piperidin-1-yl]ethanone

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-[3-(4-cyclohexylpiperazin-1-yl)carbonyl-6-methyl-pyridin-2-yl]piperidin-1-yl]ethanone Openeye Name: 2-(4-chlorophenoxy)-1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methyl-2-pyridyl]-1-piperidyl]ethanone CAS Name: 2-(4-chlorophenoxy)-1-[4-[3-[(4-cyclohexyl-1-piperazinyl)-oxomethyl]-6-methyl-2-pyridinyl]-1-piperidinyl]ethanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methylpyridin-2-yl]piperidin-1-yl]ethanone Traditional Name: 2-(4-chlorophenoxy)-1-[4-[3-(4-cyclohexylpiperazine-1-carbonyl)-6-methyl-2-pyridyl]piperidino]ethanone Formula: C30H39ClN4O3 MolecularWeight: 539.10866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)C(=O)COC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C3CCCCC3)C4CCN(CC4)C(=O)COC5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H39ClN4O3/c1-22-7-12-27(30(37)35-19-17-33(18-20-35)25-5-3-2-4-6-25)29(32-22)23-13-15-34(16-14-23)28(36)21-38-26-10-8-24(31)9-11-26/h7-12,23,25H,2-6,13-21H2,1H3