1,1,2,3,3-pentamethylisoquinolin-4-one hydrochloride

Systemtic Name: 1,1,2,3,3-pentamethylisoquinolin-4-one hydrochloride Openeye Name: 1,1,2,3,3-pentamethylisoquinolin-4-one hydrochloride CAS Name: 1,1,2,3,3-pentamethyl-4-isoquinolinone hydrochloride IUPAC Name: 1,1,2,3,3-pentamethylisoquinolin-4-one hydrochloride Traditional Name: 1,1,2,3,3-pentamethylisoquinolin-4-one hydrochloride Formula: C14H20ClNO MolecularWeight: 253.7677

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(=O)C(N1C)(C)C)C.Cl

Isomeric SMILES

CC1(C2=CC=CC=C2C(=O)C(N1C)(C)C)C.Cl

InChI

InChI=1S/C14H19NO.ClH/c1-13(2)11-9-7-6-8-10(11)12(16)14(3,4)15(13)5;/h6-9H,1-5H3;1H