2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methyl-phenyl]ethynyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methyl-phenyl]ethynyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methyl-phenyl]ethynyl]phenyl]acetic acid CAS Name: 2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methylphenyl]ethynyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methylphenyl]ethynyl]phenyl]acetic acid Traditional Name: 2-[4-[2-[4-[[cyclopropyl(ethyl)amino]methyl]-3-methyl-phenyl]ethynyl]phenyl]acetic acid Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)CC(=O)O)C)C3CC3

Isomeric SMILES

CCN(CC1=C(C=C(C=C1)C#CC2=CC=C(C=C2)CC(=O)O)C)C3CC3

InChI

InChI=1S/C23H25NO2/c1-3-24(22-12-13-22)16-21-11-10-19(14-17(21)2)7-4-18-5-8-20(9-6-18)15-23(25)26/h5-6,8-11,14,22H,3,12-13,15-16H2,1-2H3,(H,25,26)