4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-isopropyl-2-methyl-4-oxo-butanoic acid CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-2-isopropyl-4-keto-2-methyl-butyric acid Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC(=O)N1CCC2=CC=CC=C2C1)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC(=O)N1CCC2=CC=CC=C2C1)C(=O)O

InChI

InChI=1S/C17H23NO3/c1-12(2)17(3,16(20)21)10-15(19)18-9-8-13-6-4-5-7-14(13)11-18/h4-7,12H,8-11H2,1-3H3,(H,20,21)