methyl 3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]cyclohexane-1-carboxylate

Systemtic Name: methyl 3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]cyclohexane-1-carboxylate Openeye Name: methyl 3-[4-[4-(4-pyridyl)piperazin-1-yl]phenoxy]cyclohexanecarboxylate CAS Name: 3-[4-(4-pyridin-4-yl-1-piperazinyl)phenoxy]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(4-pyridin-4-ylpiperazin-1-yl)phenoxy]cyclohexane-1-carboxylate Traditional Name: 3-[4-[4-(4-pyridyl)piperazino]phenoxy]cyclohexanecarboxylic acid methyl ester Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC(C1)OC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

COC(=O)C1CCCC(C1)OC2=CC=C(C=C2)N3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C23H29N3O3/c1-28-23(27)18-3-2-4-22(17-18)29-21-7-5-19(6-8-21)25-13-15-26(16-14-25)20-9-11-24-12-10-20/h5-12,18,22H,2-4,13-17H2,1H3