methyl (E)-4-(1,3-diazinan-2-ylidene)-5-oxidanylidene-5-phenyl-pent-2-enoate

Systemtic Name: methyl (E)-4-(1,3-diazinan-2-ylidene)-5-oxidanylidene-5-phenyl-pent-2-enoate Openeye Name: methyl (E)-4-hexahydropyrimidin-2-ylidene-5-oxo-5-phenyl-pent-2-enoate CAS Name: (E)-4-(1,3-diazinan-2-ylidene)-5-oxo-5-phenyl-2-pentenoic acid methyl ester IUPAC Name: methyl (E)-4-(1,3-diazinan-2-ylidene)-5-oxo-5-phenylpent-2-enoate Traditional Name: (E)-4-hexahydropyrimidin-2-ylidene-5-keto-5-phenyl-pent-2-enoic acid methyl ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=C1NCCCN1)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C/C(=C1NCCCN1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18N2O3/c1-21-14(19)9-8-13(16-17-10-5-11-18-16)15(20)12-6-3-2-4-7-12/h2-4,6-9,17-18H,5,10-11H2,1H3/b9-8+