actinium; 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-methoxy-phenyl]propan-1-ol

Systemtic Name: actinium; 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-methoxy-phenyl]propan-1-ol Openeye Name: actinium; 3-[4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-2-methoxy-phenyl]propan-1-ol CAS Name: actinium; 3-[4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-2-methoxyphenyl]-1-propanol IUPAC Name: actinium; 3-[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-methoxyphenyl]propan-1-ol Traditional Name: actinium; 3-[4-[1-(4-ethylpiperazino)-3-isoquinolyl]-2-methoxy-phenyl]propan-1-ol Formula: C25H31AcN3O2 MolecularWeight: 632.560287

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CCCO)OC.[Ac]

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC(=C(C=C4)CCCO)OC.[Ac]

InChI

InChI=1S/C25H31N3O2.Ac/c1-3-27-12-14-28(15-13-27)25-22-9-5-4-7-20(22)17-23(26-25)21-11-10-19(8-6-16-29)24(18-21)30-2;/h4-5,7,9-11,17-18,29H,3,6,8,12-16H2,1-2H3;