2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(3-phenylmethoxyphenyl)ethanol hydrochloride

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(3-phenylmethoxyphenyl)ethanol hydrochloride Openeye Name: 1-(3-benzyloxyphenyl)-2-[2-(3,4-dimethoxyphenyl)ethylamino]ethanol hydrochloride CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(3-phenylmethoxyphenyl)ethanol hydrochloride IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethylamino]-1-(3-phenylmethoxyphenyl)ethanol hydrochloride Traditional Name: 1-(3-benzoxyphenyl)-2-(homoveratrylamino)ethanol hydrochloride Formula: C25H30ClNO4 MolecularWeight: 443.963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(C2=CC(=CC=C2)OCC3=CC=CC=C3)O)OC.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(C2=CC(=CC=C2)OCC3=CC=CC=C3)O)OC.Cl

InChI

InChI=1S/C25H29NO4.ClH/c1-28-24-12-11-19(15-25(24)29-2)13-14-26-17-23(27)21-9-6-10-22(16-21)30-18-20-7-4-3-5-8-20;/h3-12,15-16,23,26-27H,13-14,17-18H2,1-2H3;1H