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

Systemtic Name: ethyl 5-[(Z)-(3-imidazol-2-ylidene-5-oxidanylidene-pyrazolidin-4-ylidene)methyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[(Z)-(3-imidazol-2-ylidene-5-oxo-pyrazolidin-4-ylidene)methyl]-1H-pyrrole-3-carboxylate CAS Name: 5-[(Z)-[3-(2-imidazolylidene)-5-oxo-4-pyrazolidinylidene]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(Z)-(3-imidazol-2-ylidene-5-oxopyrazolidin-4-ylidene)methyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[(Z)-(3-imidazol-2-ylidene-5-keto-pyrazolidin-4-ylidene)methyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC(=C1)C=C2C(=C3N=CC=N3)NNC2=O

Isomeric SMILES

CCOC(=O)C1=CNC(=C1)/C=C\2/C(=C3N=CC=N3)NNC2=O

InChI

InChI=1S/C14H13N5O3/c1-2-22-14(21)8-5-9(17-7-8)6-10-11(18-19-13(10)20)12-15-3-4-16-12/h3-7,17-18H,2H2,1H3,(H,19,20)/b10-6-