4-[1-(4-ethylpiperazin-1-yl)-2H-isoquinolin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-(4-ethylpiperazin-1-yl)-2H-isoquinolin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-(4-ethylpiperazin-1-yl)-2H-isoquinolin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[1-(4-ethyl-1-piperazinyl)-2H-isoquinolin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-(4-ethylpiperazin-1-yl)-2H-isoquinolin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-(4-ethylpiperazino)-2H-isoquinolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C3C=CC=CC3=CC(=C4C=CC(=O)C=C4)N2

Isomeric SMILES

CCN1CCN(CC1)C2=C3C=CC=CC3=CC(=C4C=CC(=O)C=C4)N2

InChI

InChI=1S/C21H23N3O/c1-2-23-11-13-24(14-12-23)21-19-6-4-3-5-17(19)15-20(22-21)16-7-9-18(25)10-8-16/h3-10,15,22H,2,11-14H2,1H3