dimethyl (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-methoxy-3-oxidanyl-prop-2-enylidene)hept-2-enedioate

Systemtic Name: dimethyl (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-methoxy-3-oxidanyl-prop-2-enylidene)hept-2-enedioate Openeye Name: dimethyl (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-hydroxy-3-methoxy-prop-2-enylidene)hept-2-enedioate CAS Name: (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-hydroxy-3-methoxyprop-2-enylidene)-2-heptenedioic acid dimethyl ester IUPAC Name: dimethyl (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-hydroxy-3-methoxyprop-2-enylidene)hept-2-enedioate Traditional Name: (Z,4Z,5S)-2,5-dicyano-4-(2-cyano-3-hydroxy-3-methoxy-prop-2-enylidene)hept-2-enedioic 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(O)OC)C#N)C=C(C#N)C(=O)OC

Isomeric SMILES

COC(=O)C[C@H](C#N)/C(=C\C(=C(O)OC)C#N)/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/h4-5,11,21H,6H2,1-3H3/b10-4-,13-5-,15-12?/t11-/m1/s1