4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluoranyl-benzaldehyde

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluoranyl-benzaldehyde Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-2-fluoro-benzaldehyde CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-2-fluorobenzaldehyde IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-2-fluorobenzaldehyde Traditional Name: 4-[1-(4-ethylpiperazino)-3-isoquinolyl]-2-fluoro-benzaldehyde Formula: C22H22FN3O MolecularWeight: 363.427983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22FN3O/c1-2-25-9-11-26(12-10-25)22-19-6-4-3-5-16(19)14-21(24-22)17-7-8-18(15-27)20(23)13-17/h3-8,13-15H,2,9-12H2,1H3