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

Systemtic Name: 3-(4-azanylpiperazin-1-yl)-2H-isoquinolin-1-one Openeye Name: 3-(4-aminopiperazin-1-yl)-2H-isoquinolin-1-one CAS Name: 3-(4-amino-1-piperazinyl)-2H-isoquinolin-1-one IUPAC Name: 3-(4-aminopiperazin-1-yl)-2H-isoquinolin-1-one Traditional Name: 3-(4-aminopiperazino)isocarbostyril Formula: C13H16N4O MolecularWeight: 244.29234

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC3=CC=CC=C3C(=O)N2)N

Isomeric SMILES

C1CN(CCN1C2=CC3=CC=CC=C3C(=O)N2)N

InChI

InChI=1S/C13H16N4O/c14-17-7-5-16(6-8-17)12-9-10-3-1-2-4-11(10)13(18)15-12/h1-4,9H,5-8,14H2,(H,15,18)