ethyl 4-[(4Z)-4-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: ethyl 4-[(4Z)-4-[(3-chloranyl-5-methoxy-4-phenylmethoxy-phenyl)methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: ethyl 4-[(4Z)-4-[(4-benzyloxy-3-chloro-5-methoxy-phenyl)methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4Z)-4-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4Z)-4-[(3-chloro-5-methoxy-4-phenylmethoxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4Z)-4-(4-benzoxy-3-chloro-5-methoxy-benzylidene)-5-keto-3-methyl-2-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C28H25ClN2O5 MolecularWeight: 504.9615

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC4=CC=CC=C4)OC)C(=N2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C\C3=CC(=C(C(=C3)Cl)OCC4=CC=CC=C4)OC)/C(=N2)C

InChI

InChI=1S/C28H25ClN2O5/c1-4-35-28(33)21-10-12-22(13-11-21)31-27(32)23(18(2)30-31)14-20-15-24(29)26(25(16-20)34-3)36-17-19-8-6-5-7-9-19/h5-16H,4,17H2,1-3H3/b23-14-