5-(piperidin-4-ylamino)-2H-isoquinolin-1-one

Systemtic Name: 5-(piperidin-4-ylamino)-2H-isoquinolin-1-one Openeye Name: 5-(4-piperidylamino)-2H-isoquinolin-1-one CAS Name: 5-(4-piperidinylamino)-2H-isoquinolin-1-one IUPAC Name: 5-(piperidin-4-ylamino)-2H-isoquinolin-1-one Traditional Name: 5-(4-piperidylamino)isocarbostyril Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=CC=CC3=C2C=CNC3=O

Isomeric SMILES

C1CNCCC1NC2=CC=CC3=C2C=CNC3=O

InChI

InChI=1S/C14H17N3O/c18-14-12-2-1-3-13(11(12)6-9-16-14)17-10-4-7-15-8-5-10/h1-3,6,9-10,15,17H,4-5,7-8H2,(H,16,18)