1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dichloride

Systemtic Name: 1-(2-methoxy-4-prop-2-enyl-phenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dichloride Openeye Name: 1-(4-allyl-2-methoxy-phenoxy)-3-[4-(2-pyridyl)piperazin-1-yl]propan-2-ol dichloride CAS Name: 1-(2-methoxy-4-prop-2-enylphenoxy)-3-[4-(2-pyridinyl)-1-piperazinyl]-2-propanol dichloride IUPAC Name: 1-(2-methoxy-4-prop-2-enylphenoxy)-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dichloride Traditional Name: 1-(4-allyl-2-methoxy-phenoxy)-3-[4-(2-pyridyl)piperazino]propan-2-ol dichloride Formula: C22H29Cl2N3O3-2 MolecularWeight: 454.38996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.[Cl-].[Cl-]

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.[Cl-].[Cl-]

InChI

InChI=1S/C22H29N3O3.2ClH/c1-3-6-18-8-9-20(21(15-18)27-2)28-17-19(26)16-24-11-13-25(14-12-24)22-7-4-5-10-23-22;;/h3-5,7-10,15,19,26H,1,6,11-14,16-17H2,2H3;2*1H/p-2