3-(4-azanylpiperazin-1-yl)-5-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-(4-azanylpiperazin-1-yl)-5-methyl-2H-isoquinolin-1-one Openeye Name: 3-(4-aminopiperazin-1-yl)-5-methyl-2H-isoquinolin-1-one CAS Name: 3-(4-amino-1-piperazinyl)-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-(4-aminopiperazin-1-yl)-5-methyl-2H-isoquinolin-1-one Traditional Name: 3-(4-aminopiperazino)-5-methyl-isocarbostyril Formula: C14H18N4O MolecularWeight: 258.31892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)N3CCN(CC3)N

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)N3CCN(CC3)N

InChI

InChI=1S/C14H18N4O/c1-10-3-2-4-11-12(10)9-13(16-14(11)19)17-5-7-18(15)8-6-17/h2-4,9H,5-8,15H2,1H3,(H,16,19)