methyl 4-chloranyl-3-[5-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-chloranyl-3-[5-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 4-chloro-3-[5-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]-2-furyl]benzoate CAS Name: 4-chloro-3-[5-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[5-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-chloro-3-[5-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-2-furyl]benzoic acid methyl ester Formula: C23H17ClN2O4 MolecularWeight: 420.84508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=C(C=CC(=C3)C(=O)OC)Cl)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(O2)C3=C(C=CC(=C3)C(=O)OC)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H17ClN2O4/c1-14-18(22(27)26(25-14)16-6-4-3-5-7-16)13-17-9-11-21(30-17)19-12-15(23(28)29-2)8-10-20(19)24/h3-13H,1-2H3/b18-13+