methyl 5-ethoxy-2-[(Z)-(3-imidazol-2-ylidene-5-oxidanylidene-pyrazolidin-4-ylidene)methyl]-4-(2-methoxy-2-oxidanylidene-ethyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-ethoxy-2-[(Z)-(3-imidazol-2-ylidene-5-oxidanylidene-pyrazolidin-4-ylidene)methyl]-4-(2-methoxy-2-oxidanylidene-ethyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-ethoxy-2-[(Z)-(3-imidazol-2-ylidene-5-oxo-pyrazolidin-4-ylidene)methyl]-4-(2-methoxy-2-oxo-ethyl)-1H-pyrrole-3-carboxylate CAS Name: 5-ethoxy-2-[(Z)-[3-(2-imidazolylidene)-5-oxo-4-pyrazolidinylidene]methyl]-4-(2-methoxy-2-oxoethyl)-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-ethoxy-2-[(Z)-(3-imidazol-2-ylidene-5-oxopyrazolidin-4-ylidene)methyl]-4-(2-methoxy-2-oxoethyl)-1H-pyrrole-3-carboxylate Traditional Name: 5-ethoxy-2-[(Z)-(3-imidazol-2-ylidene-5-keto-pyrazolidin-4-ylidene)methyl]-4-(2-keto-2-methoxy-ethyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(N1)C=C2C(=C3N=CC=N3)NNC2=O)C(=O)OC)CC(=O)OC

Isomeric SMILES

CCOC1=C(C(=C(N1)/C=C\2/C(=C3N=CC=N3)NNC2=O)C(=O)OC)CC(=O)OC

InChI

InChI=1S/C18H19N5O6/c1-4-29-17-9(8-12(24)27-2)13(18(26)28-3)11(21-17)7-10-14(22-23-16(10)25)15-19-5-6-20-15/h5-7,21-22H,4,8H2,1-3H3,(H,23,25)/b10-7-