4-(2,2-diethoxyethyl)-2-methyl-isoquinolin-1-one

Systemtic Name: 4-(2,2-diethoxyethyl)-2-methyl-isoquinolin-1-one Openeye Name: 4-(2,2-diethoxyethyl)-2-methyl-isoquinolin-1-one CAS Name: 4-(2,2-diethoxyethyl)-2-methyl-1-isoquinolinone IUPAC Name: 4-(2,2-diethoxyethyl)-2-methylisoquinolin-1-one Traditional Name: 4-(2,2-diethoxyethyl)-2-methyl-isocarbostyril Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CN(C(=O)C2=CC=CC=C21)C)OCC

Isomeric SMILES

CCOC(CC1=CN(C(=O)C2=CC=CC=C21)C)OCC

InChI

InChI=1S/C16H21NO3/c1-4-19-15(20-5-2)10-12-11-17(3)16(18)14-9-7-6-8-13(12)14/h6-9,11,15H,4-5,10H2,1-3H3