6-(4-methylpiperazin-1-yl)-3-phenyl-2H-isoquinolin-1-one

Systemtic Name: 6-(4-methylpiperazin-1-yl)-3-phenyl-2H-isoquinolin-1-one Openeye Name: 6-(4-methylpiperazin-1-yl)-3-phenyl-2H-isoquinolin-1-one CAS Name: 6-(4-methyl-1-piperazinyl)-3-phenyl-2H-isoquinolin-1-one IUPAC Name: 6-(4-methylpiperazin-1-yl)-3-phenyl-2H-isoquinolin-1-one Traditional Name: 6-(4-methylpiperazino)-3-phenyl-isocarbostyril Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)C(=O)NC(=C3)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)C(=O)NC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O/c1-22-9-11-23(12-10-22)17-7-8-18-16(13-17)14-19(21-20(18)24)15-5-3-2-4-6-15/h2-8,13-14H,9-12H2,1H3,(H,21,24)