4-[(4-methylpiperazin-1-yl)methylidene]-2-phenyl-isoquinoline-1,3-dione

Systemtic Name: 4-[(4-methylpiperazin-1-yl)methylidene]-2-phenyl-isoquinoline-1,3-dione Openeye Name: 4-[(4-methylpiperazin-1-yl)methylene]-2-phenyl-isoquinoline-1,3-dione CAS Name: 4-[(4-methyl-1-piperazinyl)methylidene]-2-phenylisoquinoline-1,3-dione IUPAC Name: 4-[(4-methylpiperazin-1-yl)methylidene]-2-phenylisoquinoline-1,3-dione Traditional Name: 4-[(4-methylpiperazino)methylene]-2-phenyl-isoquinoline-1,3-quinone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-22-11-13-23(14-12-22)15-19-17-9-5-6-10-18(17)20(25)24(21(19)26)16-7-3-2-4-8-16/h2-10,15H,11-14H2,1H3