[3-(hydroxymethyl)-2-[[6-(4-thiophen-2-ylbutoxy)hexylamino]methyl]phenyl]methanol

Systemtic Name: [3-(hydroxymethyl)-2-[[6-(4-thiophen-2-ylbutoxy)hexylamino]methyl]phenyl]methanol Openeye Name: [3-(hydroxymethyl)-2-[[6-[4-(2-thienyl)butoxy]hexylamino]methyl]phenyl]methanol CAS Name: [3-(hydroxymethyl)-2-[[6-(4-thiophen-2-ylbutoxy)hexylamino]methyl]phenyl]methanol IUPAC Name: [3-(hydroxymethyl)-2-[[6-(4-thiophen-2-ylbutoxy)hexylamino]methyl]phenyl]methanol Traditional Name: [3-methylol-2-[[6-[4-(2-thienyl)butoxy]hexylamino]methyl]phenyl]methanol Formula: C23H35NO3S MolecularWeight: 405.5939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CO)CNCCCCCCOCCCCC2=CC=CS2)CO

Isomeric SMILES

C1=CC(=C(C(=C1)CO)CNCCCCCCOCCCCC2=CC=CS2)CO

InChI

InChI=1S/C23H35NO3S/c25-18-20-9-7-10-21(19-26)23(20)17-24-13-4-1-2-5-14-27-15-6-3-11-22-12-8-16-28-22/h7-10,12,16,24-26H,1-6,11,13-15,17-19H2