2,4,4-trimethyl-3H-isoquinolin-1-one

Systemtic Name: 2,4,4-trimethyl-3H-isoquinolin-1-one Openeye Name: 2,4,4-trimethyl-3H-isoquinolin-1-one CAS Name: 2,4,4-trimethyl-3H-isoquinolin-1-one IUPAC Name: 2,4,4-trimethyl-3H-isoquinolin-1-one Traditional Name: 2,4,4-trimethyl-3H-isoquinolin-1-one Formula: C12H15NO MolecularWeight: 189.2536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO/c1-12(2)8-13(3)11(14)9-6-4-5-7-10(9)12/h4-7H,8H2,1-3H3