1-[5-[[cyclohexyl(prop-2-ynyl)amino]methyl]-2-methoxy-phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol

Systemtic Name: 1-[5-[[cyclohexyl(prop-2-ynyl)amino]methyl]-2-methoxy-phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol Openeye Name: 1-[5-[[cyclohexyl(prop-2-ynyl)amino]methyl]-2-methoxy-phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol CAS Name: 1-[5-[[cyclohexyl(prop-2-ynyl)amino]methyl]-2-methoxyphenoxy]-3-(4-methyl-1-piperazinyl)-2-propanol IUPAC Name: 1-[5-[[cyclohexyl(prop-2-ynyl)amino]methyl]-2-methoxyphenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol Traditional Name: 1-[5-[[cyclohexyl(propargyl)amino]methyl]-2-methoxy-phenoxy]-3-(4-methylpiperazino)propan-2-ol Formula: C25H39N3O3 MolecularWeight: 429.59546

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(COC2=C(C=CC(=C2)CN(CC#C)C3CCCCC3)OC)O

Isomeric SMILES

CN1CCN(CC1)CC(COC2=C(C=CC(=C2)CN(CC#C)C3CCCCC3)OC)O

InChI

InChI=1S/C25H39N3O3/c1-4-12-28(22-8-6-5-7-9-22)18-21-10-11-24(30-3)25(17-21)31-20-23(29)19-27-15-13-26(2)14-16-27/h1,10-11,17,22-23,29H,5-9,12-16,18-20H2,2-3H3