ethyl (5Z)-4-[(3-chlorophenyl)methyl]-2-methyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (5Z)-4-[(3-chlorophenyl)methyl]-2-methyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (5Z)-4-[(3-chlorophenyl)methyl]-2-methyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]pyrrole-3-carboxylate CAS Name: (5Z)-4-[(3-chlorophenyl)methyl]-2-methyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-4-[(3-chlorophenyl)methyl]-2-methyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (5Z)-4-(3-chlorobenzyl)-5-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C26H24ClN3O3 MolecularWeight: 461.94006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC2=C(NN(C2=O)C3=CC=CC=C3)C)N=C1C)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(/C(=C/C2=C(NN(C2=O)C3=CC=CC=C3)C)/N=C1C)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H24ClN3O3/c1-4-33-26(32)24-17(3)28-23(22(24)14-18-9-8-10-19(27)13-18)15-21-16(2)29-30(25(21)31)20-11-6-5-7-12-20/h5-13,15,29H,4,14H2,1-3H3/b23-15-