1,3-benzoxazol-2-ylmethyl 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanoate Openeye Name: 1,3-benzoxazol-2-ylmethyl 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate CAS Name: 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanoate Traditional Name: 3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)OCC2=NC3=CC=CC=C3O2)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)OCC2=NC3=CC=CC=C3O2)C)C#N

InChI

InChI=1S/C19H17N3O4/c1-11-13(12(2)21-19(24)14(11)9-20)7-8-18(23)25-10-17-22-15-5-3-4-6-16(15)26-17/h3-6H,7-8,10H2,1-2H3,(H,21,24)