4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline hydrochloride

Systemtic Name: 4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline hydrochloride Openeye Name: 4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline hydrochloride CAS Name: 4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethyl-1-piperazinyl)isoquinoline hydrochloride IUPAC Name: 4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethylpiperazin-1-yl)isoquinoline hydrochloride Traditional Name: 4-[2,3-bis(2-methoxyethoxy)phenyl]-1-(4-ethylpiperazino)isoquinoline hydrochloride Formula: C27H36ClN3O4 MolecularWeight: 502.04544

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C4=C(C(=CC=C4)OCCOC)OCCOC.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC=C(C3=CC=CC=C32)C4=C(C(=CC=C4)OCCOC)OCCOC.Cl

InChI

InChI=1S/C27H35N3O4.ClH/c1-4-29-12-14-30(15-13-29)27-23-9-6-5-8-21(23)24(20-28-27)22-10-7-11-25(33-18-16-31-2)26(22)34-19-17-32-3;/h5-11,20H,4,12-19H2,1-3H3;1H