[1-[(6-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [1-[(6-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-4-carboxylate Openeye Name: 1-[(6-methyl-2-pyridyl)carbamoyl]propyl 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [1-[(6-methyl-2-pyridinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(6-methylpyridin-2-yl)amino]-1-oxobutan-2-yl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid 1-[(6-methyl-2-pyridyl)carbamoyl]propyl ester Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=N1)C)OC(=O)C2=C3C(=CC=C2)OC=N3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=N1)C)OC(=O)C2=C3C(=CC=C2)OC=N3

InChI

InChI=1S/C18H17N3O4/c1-3-13(17(22)21-15-9-4-6-11(2)20-15)25-18(23)12-7-5-8-14-16(12)19-10-24-14/h4-10,13H,3H2,1-2H3,(H,20,21,22)