3-azanyl-4-[2-(dimethylamino)ethanoyl]-2H-isoquinolin-1-one

Systemtic Name: 3-azanyl-4-[2-(dimethylamino)ethanoyl]-2H-isoquinolin-1-one Openeye Name: 3-amino-4-[2-(dimethylamino)acetyl]-2H-isoquinolin-1-one CAS Name: 3-amino-4-[2-(dimethylamino)-1-oxoethyl]-2H-isoquinolin-1-one IUPAC Name: 3-amino-4-[2-(dimethylamino)acetyl]-2H-isoquinolin-1-one Traditional Name: 3-amino-4-[2-(dimethylamino)acetyl]isocarbostyril Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=O)C1=C(NC(=O)C2=CC=CC=C21)N

Isomeric SMILES

CN(C)CC(=O)C1=C(NC(=O)C2=CC=CC=C21)N

InChI

InChI=1S/C13H15N3O2/c1-16(2)7-10(17)11-8-5-3-4-6-9(8)13(18)15-12(11)14/h3-6H,7H2,1-2H3,(H3,14,15,18)