methyl (E)-2-cyano-3-(4-oxidanylidene-5-phenylmethoxy-pyran-2-yl)prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(4-oxidanylidene-5-phenylmethoxy-pyran-2-yl)prop-2-enoate Openeye Name: methyl (E)-3-(5-benzyloxy-4-oxo-pyran-2-yl)-2-cyano-prop-2-enoate CAS Name: (E)-2-cyano-3-(4-oxo-5-phenylmethoxy-2-pyranyl)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(4-oxo-5-phenylmethoxypyran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-benzoxy-4-keto-pyran-2-yl)-2-cyano-acrylic acid methyl ester Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=O)C(=CO1)OCC2=CC=CC=C2)C#N

Isomeric SMILES

COC(=O)/C(=C/C1=CC(=O)C(=CO1)OCC2=CC=CC=C2)/C#N

InChI

InChI=1S/C17H13NO5/c1-21-17(20)13(9-18)7-14-8-15(19)16(11-22-14)23-10-12-5-3-2-4-6-12/h2-8,11H,10H2,1H3/b13-7+