[3-(hydroxymethyl)-2-[[7-(4-phenylbut-3-ynoxy)heptan-2-ylamino]methyl]phenyl]methanol

Systemtic Name: [3-(hydroxymethyl)-2-[[7-(4-phenylbut-3-ynoxy)heptan-2-ylamino]methyl]phenyl]methanol Openeye Name: [3-(hydroxymethyl)-2-[[[1-methyl-6-(4-phenylbut-3-ynoxy)hexyl]amino]methyl]phenyl]methanol CAS Name: [3-(hydroxymethyl)-2-[[7-(4-phenylbut-3-ynoxy)heptan-2-ylamino]methyl]phenyl]methanol IUPAC Name: [3-(hydroxymethyl)-2-[[7-(4-phenylbut-3-ynoxy)heptan-2-ylamino]methyl]phenyl]methanol Traditional Name: [3-methylol-2-[[[1-methyl-6-(4-phenylbut-3-ynoxy)hexyl]amino]methyl]phenyl]methanol Formula: C26H35NO3 MolecularWeight: 409.561

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCOCCC#CC1=CC=CC=C1)NCC2=C(C=CC=C2CO)CO

Isomeric SMILES

CC(CCCCCOCCC#CC1=CC=CC=C1)NCC2=C(C=CC=C2CO)CO

InChI

InChI=1S/C26H35NO3/c1-22(27-19-26-24(20-28)15-10-16-25(26)21-29)11-4-3-8-17-30-18-9-7-14-23-12-5-2-6-13-23/h2,5-6,10,12-13,15-16,22,27-29H,3-4,8-9,11,17-21H2,1H3