methyl (Z)-3-[2-(4,5-dihydro-1H-imidazol-2-yl)-1H-phthalazin-1-yl]-4-ethoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl (Z)-3-[2-(4,5-dihydro-1H-imidazol-2-yl)-1H-phthalazin-1-yl]-4-ethoxy-4-oxidanyl-2-oxidanylidene-but-3-enoate Openeye Name: methyl (Z)-3-[2-(4,5-dihydro-1H-imidazol-2-yl)-1H-phthalazin-1-yl]-4-ethoxy-4-hydroxy-2-oxo-but-3-enoate CAS Name: (Z)-3-[2-(4,5-dihydro-1H-imidazol-2-yl)-1H-phthalazin-1-yl]-4-ethoxy-4-hydroxy-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-[2-(4,5-dihydro-1H-imidazol-2-yl)-1H-phthalazin-1-yl]-4-ethoxy-4-hydroxy-2-oxobut-3-enoate Traditional Name: (Z)-4-ethoxy-4-hydroxy-3-[2-(2-imidazolin-2-yl)-1H-phthalazin-1-yl]-2-keto-but-3-enoic acid methyl ester Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C1C2=CC=CC=C2C=NN1C3=NCCN3)C(=O)C(=O)OC)O

Isomeric SMILES

CCO/C(=C(/C1C2=CC=CC=C2C=NN1C3=NCCN3)\C(=O)C(=O)OC)/O

InChI

InChI=1S/C18H20N4O5/c1-3-27-16(24)13(15(23)17(25)26-2)14-12-7-5-4-6-11(12)10-21-22(14)18-19-8-9-20-18/h4-7,10,14,24H,3,8-9H2,1-2H3,(H,19,20)/b16-13-