ethyl 3-[2,5-dimethyl-3-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate

Systemtic Name: ethyl 3-[2,5-dimethyl-3-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate Openeye Name: ethyl 3-[2,5-dimethyl-3-[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate CAS Name: 3-[2,5-dimethyl-3-[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[2,5-dimethyl-3-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate Traditional Name: 3-[3-[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]benzoic acid ethyl ester Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C(=CC(=C2C)/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C)C

InChI

InChI=1S/C26H25N3O3/c1-5-32-26(31)20-10-9-13-23(15-20)28-17(2)14-21(19(28)4)16-24-18(3)27-29(25(24)30)22-11-7-6-8-12-22/h6-16H,5H2,1-4H3/b24-16-