methyl (2Z)-5-chloranyl-4-(2-methoxy-2-oxidanylidene-ethyl)-2-[(3-oxidanylidene-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: methyl (2Z)-5-chloranyl-4-(2-methoxy-2-oxidanylidene-ethyl)-2-[(3-oxidanylidene-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: methyl (2Z)-5-chloro-2-[(3-isopropoxy-5-oxo-1,2-dihydropyrazol-4-yl)methylene]-4-(2-methoxy-2-oxo-ethyl)pyrrole-3-carboxylate CAS Name: (2Z)-5-chloro-4-(2-methoxy-2-oxoethyl)-2-[(3-oxo-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (2Z)-5-chloro-4-(2-methoxy-2-oxoethyl)-2-[(3-oxo-5-propan-2-yloxy-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (2Z)-5-chloro-2-[(3-isopropoxy-5-keto-3-pyrazolin-4-yl)methylene]-4-(2-keto-2-methoxy-ethyl)pyrrole-3-carboxylic acid methyl ester Formula: C16H18ClN3O6 MolecularWeight: 383.78362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)NN1)C=C2C(=C(C(=N2)Cl)CC(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)OC1=C(C(=O)NN1)/C=C\2/C(=C(C(=N2)Cl)CC(=O)OC)C(=O)OC

InChI

InChI=1S/C16H18ClN3O6/c1-7(2)26-15-9(14(22)19-20-15)5-10-12(16(23)25-4)8(13(17)18-10)6-11(21)24-3/h5,7H,6H2,1-4H3,(H2,19,20,22)/b10-5-