4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]aniline

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]aniline Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]aniline CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]aniline IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]aniline Traditional Name: [4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]amine Formula: C21H24N4 MolecularWeight: 332.44206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4/c1-2-24-11-13-25(14-12-24)21-19-6-4-3-5-17(19)15-20(23-21)16-7-9-18(22)10-8-16/h3-10,15H,2,11-14,22H2,1H3