1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol hydrochloride

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol hydrochloride Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol hydrochloride CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-(4-phenylphenoxy)-2-propanol hydrochloride IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol hydrochloride Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-3-(4-phenylphenoxy)propan-2-ol hydrochloride Formula: C26H31ClN2O3 MolecularWeight: 454.98894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O.Cl

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C26H30N2O3.ClH/c1-30-26-10-6-5-9-25(26)28-17-15-27(16-18-28)19-23(29)20-31-24-13-11-22(12-14-24)21-7-3-2-4-8-21;/h2-14,23,29H,15-20H2,1H3;1H