3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline

Systemtic Name: 3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline Openeye Name: 3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline CAS Name: 3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethyl-1-piperazinyl)isoquinoline IUPAC Name: 3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline Traditional Name: 3-[3-(1,1-dimethoxyethoxy)phenyl]-1-(4-ethylpiperazino)isoquinoline Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3/c1-5-27-13-15-28(16-14-27)24-22-12-7-6-9-19(22)18-23(26-24)20-10-8-11-21(17-20)31-25(2,29-3)30-4/h6-12,17-18H,5,13-16H2,1-4H3