methyl 3-[2-[3-[(3-methyl-1,2-oxazol-5-yl)carbonylamino]phenyl]ethynyl]benzoate

Systemtic Name: methyl 3-[2-[3-[(3-methyl-1,2-oxazol-5-yl)carbonylamino]phenyl]ethynyl]benzoate Openeye Name: methyl 3-[2-[3-[(3-methylisoxazole-5-carbonyl)amino]phenyl]ethynyl]benzoate CAS Name: 3-[2-[3-[[(3-methyl-5-isoxazolyl)-oxomethyl]amino]phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[3-[(3-methyl-1,2-oxazole-5-carbonyl)amino]phenyl]ethynyl]benzoate Traditional Name: 3-[2-[3-[(3-methylisoxazole-5-carbonyl)amino]phenyl]ethynyl]benzoic acid methyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=NOC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C21H16N2O4/c1-14-11-19(27-23-14)20(24)22-18-8-4-6-16(13-18)10-9-15-5-3-7-17(12-15)21(25)26-2/h3-8,11-13H,1-2H3,(H,22,24)