2-but-3-yn-2-yl-1-(4-cyanophenyl)-3-methyl-cyclopropane-1-carboxylic acid

Systemtic Name: 2-but-3-yn-2-yl-1-(4-cyanophenyl)-3-methyl-cyclopropane-1-carboxylic acid Openeye Name: 1-(4-cyanophenyl)-2-methyl-3-(1-methylprop-2-ynyl)cyclopropanecarboxylic acid CAS Name: 2-but-3-yn-2-yl-1-(4-cyanophenyl)-3-methyl-1-cyclopropanecarboxylic acid IUPAC Name: 2-but-3-yn-2-yl-1-(4-cyanophenyl)-3-methylcyclopropane-1-carboxylic acid Traditional Name: 1-(4-cyanophenyl)-2-methyl-3-(1-methylprop-2-ynyl)cyclopropanecarboxylic acid Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C1(C2=CC=C(C=C2)C#N)C(=O)O)C(C)C#C

Isomeric SMILES

CC1C(C1(C2=CC=C(C=C2)C#N)C(=O)O)C(C)C#C

InChI

InChI=1S/C16H15NO2/c1-4-10(2)14-11(3)16(14,15(18)19)13-7-5-12(9-17)6-8-13/h1,5-8,10-11,14H,2-3H3,(H,18,19)