[1-[(4-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-5-carboxylate

Systemtic Name: [1-[(4-methylpyridin-2-yl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-5-carboxylate Openeye Name: 1-[(4-methyl-2-pyridyl)carbamoyl]propyl 1,3-benzoxazole-5-carboxylate CAS Name: 1,3-benzoxazole-5-carboxylic acid [1-[(4-methyl-2-pyridinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(4-methylpyridin-2-yl)amino]-1-oxobutan-2-yl] 1,3-benzoxazole-5-carboxylate Traditional Name: 1,3-benzoxazole-5-carboxylic acid 1-[(4-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=NC=CC(=C1)C)OC(=O)C2=CC3=C(C=C2)OC=N3

Isomeric SMILES

CCC(C(=O)NC1=NC=CC(=C1)C)OC(=O)C2=CC3=C(C=C2)OC=N3

InChI

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