ethyl (4E)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyrrole-2-carboxylate

Systemtic Name: ethyl (4E)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyrrole-2-carboxylate Openeye Name: ethyl (4E)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyrrole-2-carboxylate CAS Name: (4E)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4E)-4-[4-(3-chlorophenyl)-1,2-dihydropyrazol-3-ylidene]pyrrole-2-carboxylate Traditional Name: (4E)-4-[4-(3-chlorophenyl)-3-pyrazolin-3-ylidene]pyrrole-2-carboxylic acid ethyl ester Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C(=CNN2)C3=CC(=CC=C3)Cl)C=N1

Isomeric SMILES

CCOC(=O)C1=C/C(=C\2/C(=CNN2)C3=CC(=CC=C3)Cl)/C=N1

InChI

InChI=1S/C16H14ClN3O2/c1-2-22-16(21)14-7-11(8-18-14)15-13(9-19-20-15)10-4-3-5-12(17)6-10/h3-9,19-20H,2H2,1H3/b15-11+