1-[3-(2-ethoxyphenoxy)-3-phenyl-propyl]-4-methyl-piperazine hydrate hydrochloride

Systemtic Name: 1-[3-(2-ethoxyphenoxy)-3-phenyl-propyl]-4-methyl-piperazine hydrate hydrochloride Openeye Name: 1-[3-(2-ethoxyphenoxy)-3-phenyl-propyl]-4-methyl-piperazine hydrate hydrochloride CAS Name: 1-[3-(2-ethoxyphenoxy)-3-phenylpropyl]-4-methylpiperazine hydrate hydrochloride IUPAC Name: 1-[3-(2-ethoxyphenoxy)-3-phenylpropyl]-4-methylpiperazine hydrate hydrochloride Traditional Name: 1-[3-(2-ethoxyphenoxy)-3-phenyl-propyl]-4-methyl-piperazine hydrate hydrochloride Formula: C22H33ClN2O3 MolecularWeight: 408.96202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OC(CCN2CCN(CC2)C)C3=CC=CC=C3.O.Cl

Isomeric SMILES

CCOC1=CC=CC=C1OC(CCN2CCN(CC2)C)C3=CC=CC=C3.O.Cl

InChI

InChI=1S/C22H30N2O2.ClH.H2O/c1-3-25-21-11-7-8-12-22(21)26-20(19-9-5-4-6-10-19)13-14-24-17-15-23(2)16-18-24;;/h4-12,20H,3,13-18H2,1-2H3;1H;1H2