[2-(aminomethyl)-3-(hydroxymethyl)-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol

Systemtic Name: [2-(aminomethyl)-3-(hydroxymethyl)-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol Openeye Name: [2-(aminomethyl)-3-(hydroxymethyl)-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol CAS Name: [2-(aminomethyl)-3-(hydroxymethyl)-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol IUPAC Name: [2-(aminomethyl)-3-(hydroxymethyl)-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol Traditional Name: [2-(aminomethyl)-3-methylol-4-[6-(4-phenylbutoxy)hexyl]phenyl]methanol Formula: C25H37NO3 MolecularWeight: 399.56618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOCCCCCCC2=C(C(=C(C=C2)CO)CN)CO

Isomeric SMILES

C1=CC=C(C=C1)CCCCOCCCCCCC2=C(C(=C(C=C2)CO)CN)CO

InChI

InChI=1S/C25H37NO3/c26-18-24-23(19-27)15-14-22(25(24)20-28)13-6-1-2-8-16-29-17-9-7-12-21-10-4-3-5-11-21/h3-5,10-11,14-15,27-28H,1-2,6-9,12-13,16-20,26H2