methyl 3-[2-[3-[(2-methylcyclopropyl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(2-methylcyclopropyl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(2-methylcyclopropanecarbonyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(2-methylcyclopropyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(2-methylcyclopropanecarbonyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(2-methylcyclopropanecarbonyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1CC1C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19NO3/c1-14-11-19(14)20(23)22-18-8-4-6-16(13-18)10-9-15-5-3-7-17(12-15)21(24)25-2/h3-8,12-14,19H,11H2,1-2H3,(H,22,23)