2-(2-hydroxyethyl)-4-[1-oxidanyl-2-(7-phenethyloxyheptan-2-ylamino)ethyl]phenol hydrochloride

Systemtic Name: 2-(2-hydroxyethyl)-4-[1-oxidanyl-2-(7-phenethyloxyheptan-2-ylamino)ethyl]phenol hydrochloride Openeye Name: 2-(2-hydroxyethyl)-4-[1-hydroxy-2-[(1-methyl-6-phenethyloxy-hexyl)amino]ethyl]phenol hydrochloride CAS Name: 2-(2-hydroxyethyl)-4-[1-hydroxy-2-(7-phenethyloxyheptan-2-ylamino)ethyl]phenol hydrochloride IUPAC Name: 2-(2-hydroxyethyl)-4-[1-hydroxy-2-(7-phenethyloxyheptan-2-ylamino)ethyl]phenol hydrochloride Traditional Name: 2-(2-hydroxyethyl)-4-[1-hydroxy-2-[(1-methyl-6-phenethyloxy-hexyl)amino]ethyl]phenol hydrochloride Formula: C25H38ClNO4 MolecularWeight: 452.02652

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCOCCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)CCO)O.Cl

Isomeric SMILES

CC(CCCCCOCCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)CCO)O.Cl

InChI

InChI=1S/C25H37NO4.ClH/c1-20(8-4-3-7-16-30-17-14-21-9-5-2-6-10-21)26-19-25(29)22-11-12-24(28)23(18-22)13-15-27;/h2,5-6,9-12,18,20,25-29H,3-4,7-8,13-17,19H2,1H3;1H