dimethyl (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-methoxy-3-oxidanylidene-propyl]hepta-2,4-dienedioate

Systemtic Name: dimethyl (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-methoxy-3-oxidanylidene-propyl]hepta-2,4-dienedioate Openeye Name: dimethyl (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-methoxy-3-oxo-propyl]hepta-2,4-dienedioate CAS Name: (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-methoxy-3-oxopropyl]hepta-2,4-dienedioic acid dimethyl ester IUPAC Name: dimethyl (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-methoxy-3-oxopropyl]hepta-2,4-dienedioate Traditional Name: (2Z,4Z)-2,6-dicyano-4-[(1S)-1-cyano-3-keto-3-methoxy-propyl]hepta-2,4-dienedioic acid dimethyl ester Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)C[C@H](C#N)/C(=C\C(C#N)C(=O)OC)/C=C(/C#N)\C(=O)OC

InChI

InChI=1S/C16H15N3O6/c1-23-14(20)6-11(7-17)10(4-12(8-18)15(21)24-2)5-13(9-19)16(22)25-3/h4-5,11-12H,6H2,1-3H3/b10-4-,13-5-/t11-,12?/m1/s1