ethyl 2-chloranyl-5-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzoate Openeye Name: ethyl 2-chloro-5-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]amino]benzoate CAS Name: 2-chloro-5-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-[[(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]amino]benzoate Traditional Name: 2-chloro-5-[[(Z)-[1-(3,4-dimethylphenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]amino]benzoic acid ethyl ester Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)NC=C2C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N/C=C\2/C(=NN(C2=O)C3=CC(=C(C=C3)C)C)C)Cl

InChI

InChI=1S/C22H22ClN3O3/c1-5-29-22(28)18-11-16(7-9-20(18)23)24-12-19-15(4)25-26(21(19)27)17-8-6-13(2)14(3)10-17/h6-12,24H,5H2,1-4H3/b19-12-