[3-(hydroxymethyl)-2-[[6-(4-phenylbutoxy)hexan-2-ylamino]methyl]phenyl]methanol

Systemtic Name: [3-(hydroxymethyl)-2-[[6-(4-phenylbutoxy)hexan-2-ylamino]methyl]phenyl]methanol Openeye Name: [3-(hydroxymethyl)-2-[[[1-methyl-5-(4-phenylbutoxy)pentyl]amino]methyl]phenyl]methanol CAS Name: [3-(hydroxymethyl)-2-[[6-(4-phenylbutoxy)hexan-2-ylamino]methyl]phenyl]methanol IUPAC Name: [3-(hydroxymethyl)-2-[[6-(4-phenylbutoxy)hexan-2-ylamino]methyl]phenyl]methanol Traditional Name: [3-methylol-2-[[[1-methyl-5-(4-phenylbutoxy)pentyl]amino]methyl]phenyl]methanol Formula: C25H37NO3 MolecularWeight: 399.56618

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOCCCCC1=CC=CC=C1)NCC2=C(C=CC=C2CO)CO

Isomeric SMILES

CC(CCCCOCCCCC1=CC=CC=C1)NCC2=C(C=CC=C2CO)CO

InChI

InChI=1S/C25H37NO3/c1-21(26-18-25-23(19-27)14-9-15-24(25)20-28)10-5-7-16-29-17-8-6-13-22-11-3-2-4-12-22/h2-4,9,11-12,14-15,21,26-28H,5-8,10,13,16-20H2,1H3