3-azanyl-4-[2-(dimethylamino)ethanoyl]-7-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-azanyl-4-[2-(dimethylamino)ethanoyl]-7-methyl-2H-isoquinolin-1-one Openeye Name: 3-amino-4-[2-(dimethylamino)acetyl]-7-methyl-2H-isoquinolin-1-one CAS Name: 3-amino-4-[2-(dimethylamino)-1-oxoethyl]-7-methyl-2H-isoquinolin-1-one IUPAC Name: 3-amino-4-[2-(dimethylamino)acetyl]-7-methyl-2H-isoquinolin-1-one Traditional Name: 3-amino-4-[2-(dimethylamino)acetyl]-7-methyl-isocarbostyril Formula: C14H17N3O2 MolecularWeight: 259.30368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(NC2=O)N)C(=O)CN(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(NC2=O)N)C(=O)CN(C)C

InChI

InChI=1S/C14H17N3O2/c1-8-4-5-9-10(6-8)14(19)16-13(15)12(9)11(18)7-17(2)3/h4-6H,7H2,1-3H3,(H3,15,16,19)