[1-[(2-methylquinolin-4-yl)amino]-1-oxidanylidene-propan-2-yl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [1-[(2-methylquinolin-4-yl)amino]-1-oxidanylidene-propan-2-yl] 1,3-benzoxazole-4-carboxylate Openeye Name: [1-methyl-2-[(2-methyl-4-quinolyl)amino]-2-oxo-ethyl] 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [1-[(2-methyl-4-quinolinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylquinolin-4-yl)amino]-1-oxopropan-2-yl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid [2-keto-1-methyl-2-[(2-methyl-4-quinolyl)amino]ethyl] ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)OC(=O)C3=C4C(=CC=C3)OC=N4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)OC(=O)C3=C4C(=CC=C3)OC=N4

InChI

InChI=1S/C21H17N3O4/c1-12-10-17(14-6-3-4-8-16(14)23-12)24-20(25)13(2)28-21(26)15-7-5-9-18-19(15)22-11-27-18/h3-11,13H,1-2H3,(H,23,24,25)