2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methyl-phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methyl-phenyl]ethanoic acid Openeye Name: 2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methyl-phenyl]acetic acid CAS Name: 2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methylphenyl]acetic acid IUPAC Name: 2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methylphenyl]acetic acid Traditional Name: 2-[4-[2-(2-cyclopropyl-3,4-dihydro-1H-isoquinolin-6-yl)ethynyl]-2-methyl-phenyl]acetic acid Formula: C23H23NO2 MolecularWeight: 345.43422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CC2=CC3=C(CN(CC3)C4CC4)C=C2)CC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C#CC2=CC3=C(CN(CC3)C4CC4)C=C2)CC(=O)O

InChI

InChI=1S/C23H23NO2/c1-16-12-17(4-6-19(16)14-23(25)26)2-3-18-5-7-21-15-24(22-8-9-22)11-10-20(21)13-18/h4-7,12-13,22H,8-11,14-15H2,1H3,(H,25,26)