3-azanyl-2-pentan-3-yl-isoquinolin-1-one

Systemtic Name: 3-azanyl-2-pentan-3-yl-isoquinolin-1-one Openeye Name: 3-amino-2-(1-ethylpropyl)isoquinolin-1-one CAS Name: 3-amino-2-pentan-3-yl-1-isoquinolinone IUPAC Name: 3-amino-2-pentan-3-ylisoquinolin-1-one Traditional Name: 3-amino-2-(1-ethylpropyl)isocarbostyril Formula: C14H18N2O MolecularWeight: 230.30552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=CC2=CC=CC=C2C1=O)N

Isomeric SMILES

CCC(CC)N1C(=CC2=CC=CC=C2C1=O)N

InChI

InChI=1S/C14H18N2O/c1-3-11(4-2)16-13(15)9-10-7-5-6-8-12(10)14(16)17/h5-9,11H,3-4,15H2,1-2H3