1-(azepan-1-yl)-3-[2-methoxy-4-[[prop-2-enyl(prop-2-ynyl)amino]methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[[prop-2-enyl(prop-2-ynyl)amino]methyl]phenoxy]propan-2-ol Openeye Name: 1-[4-[[allyl(prop-2-ynyl)amino]methyl]-2-methoxy-phenoxy]-3-(azepan-1-yl)propan-2-ol CAS Name: 1-(1-azepanyl)-3-[2-methoxy-4-[[prop-2-enyl(prop-2-ynyl)amino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(azepan-1-yl)-3-[2-methoxy-4-[[prop-2-enyl(prop-2-ynyl)amino]methyl]phenoxy]propan-2-ol Traditional Name: 1-[4-[[allyl(propargyl)amino]methyl]-2-methoxy-phenoxy]-3-(azepan-1-yl)propan-2-ol Formula: C23H34N2O3 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CC=C)CC#C)OCC(CN2CCCCCC2)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CC=C)CC#C)OCC(CN2CCCCCC2)O

InChI

InChI=1S/C23H34N2O3/c1-4-12-24(13-5-2)17-20-10-11-22(23(16-20)27-3)28-19-21(26)18-25-14-8-6-7-9-15-25/h1,5,10-11,16,21,26H,2,6-9,12-15,17-19H2,3H3