3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,2-dimethyl-cyclopropane-1-carboxylic acid

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,2-dimethyl-cyclopropane-1-carboxylic acid Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,2-dimethyl-cyclopropanecarboxylic acid CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,2-dimethylcyclopropane-1-carboxylic acid Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,2-dimethyl-cyclopropanecarboxylic acid Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1C(=O)O)C(=O)N2CCC3=CC=CC=C3C2)C

Isomeric SMILES

CC1(C(C1C(=O)O)C(=O)N2CCC3=CC=CC=C3C2)C

InChI

InChI=1S/C16H19NO3/c1-16(2)12(13(16)15(19)20)14(18)17-8-7-10-5-3-4-6-11(10)9-17/h3-6,12-13H,7-9H2,1-2H3,(H,19,20)