N-ethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide dihydrochloride

Systemtic Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide dihydrochloride Openeye Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]benzamide dihydrochloride CAS Name: N-ethyl-4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]benzamide dihydrochloride IUPAC Name: N-ethyl-4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]benzamide dihydrochloride Traditional Name: N-ethyl-4-[1-(4-ethylpiperazino)-3-isoquinolyl]benzamide dihydrochloride Formula: C24H30Cl2N4O MolecularWeight: 461.4272

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl.Cl

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=N2)N4CCN(CC4)CC.Cl.Cl

InChI

InChI=1S/C24H28N4O.2ClH/c1-3-25-24(29)19-11-9-18(10-12-19)22-17-20-7-5-6-8-21(20)23(26-22)28-15-13-27(4-2)14-16-28;;/h5-12,17H,3-4,13-16H2,1-2H3,(H,25,29);2*1H