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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-3-17(4-2,16(20)21)11-15(19)18-10-9-13-7-5-6-8-14(13)12-18/h5-8H,3-4,9-12H2,1-2H3,(H,20,21)