1-[3-[2-[[cyclohexyl(prop-2-ynyl)amino]methyl]-4-methoxy-phenoxy]-2-oxidanyl-propyl]piperidin-4-ol

Systemtic Name: 1-[3-[2-[[cyclohexyl(prop-2-ynyl)amino]methyl]-4-methoxy-phenoxy]-2-oxidanyl-propyl]piperidin-4-ol Openeye Name: 1-[3-[2-[[cyclohexyl(prop-2-ynyl)amino]methyl]-4-methoxy-phenoxy]-2-hydroxy-propyl]piperidin-4-ol CAS Name: 1-[3-[2-[[cyclohexyl(prop-2-ynyl)amino]methyl]-4-methoxyphenoxy]-2-hydroxypropyl]-4-piperidinol IUPAC Name: 1-[3-[2-[[cyclohexyl(prop-2-ynyl)amino]methyl]-4-methoxyphenoxy]-2-hydroxypropyl]piperidin-4-ol Traditional Name: 1-[3-[2-[[cyclohexyl(propargyl)amino]methyl]-4-methoxy-phenoxy]-2-hydroxy-propyl]piperidin-4-ol Formula: C25H38N2O4 MolecularWeight: 430.58022

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(CN2CCC(CC2)O)O)CN(CC#C)C3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(CN2CCC(CC2)O)O)CN(CC#C)C3CCCCC3

InChI

InChI=1S/C25H38N2O4/c1-3-13-27(21-7-5-4-6-8-21)17-20-16-24(30-2)9-10-25(20)31-19-23(29)18-26-14-11-22(28)12-15-26/h1,9-10,16,21-23,28-29H,4-8,11-15,17-19H2,2H3