methyl (E)-2-cyano-3-[2-(4-methoxy-4-oxidanylidene-butoxy)phenyl]prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[2-(4-methoxy-4-oxidanylidene-butoxy)phenyl]prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-[2-(4-methoxy-4-oxo-butoxy)phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(4-methoxy-4-oxobutoxy)phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-[2-(4-methoxy-4-oxobutoxy)phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-(4-keto-4-methoxy-butoxy)phenyl]acrylic acid methyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=CC=CC=C1C=C(C#N)C(=O)OC

Isomeric SMILES

COC(=O)CCCOC1=CC=CC=C1/C=C(\C#N)/C(=O)OC

InChI

InChI=1S/C16H17NO5/c1-20-15(18)8-5-9-22-14-7-4-3-6-12(14)10-13(11-17)16(19)21-2/h3-4,6-7,10H,5,8-9H2,1-2H3/b13-10+