1-(4-ethylpiperazin-1-yl)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride

Systemtic Name: 1-(4-ethylpiperazin-1-yl)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride Openeye Name: 1-(4-ethylpiperazin-1-yl)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride CAS Name: 1-(4-ethyl-1-piperazinyl)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride IUPAC Name: 1-(4-ethylpiperazin-1-yl)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride Traditional Name: 1-(4-ethylpiperazino)-3-[(4-methoxyphenoxy)methyl]isoquinoline hydrochloride Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)COC4=CC=C(C=C4)OC.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)COC4=CC=C(C=C4)OC.Cl

InChI

InChI=1S/C23H27N3O2.ClH/c1-3-25-12-14-26(15-13-25)23-22-7-5-4-6-18(22)16-19(24-23)17-28-21-10-8-20(27-2)9-11-21;/h4-11,16H,3,12-15,17H2,1-2H3;1H