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

Systemtic Name: 4-[2-[(Z)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate Openeye Name: 4-[2-[(Z)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate CAS Name: 4-[2-[(Z)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-pyrrolyl]benzoate IUPAC Name: 4-[2-[(Z)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]pyrrol-1-yl]benzoate Traditional Name: 4-[2-[(Z)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]pyrrol-1-yl]benzoate Formula: C22H16N3O3- MolecularWeight: 370.38074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=CN2C3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=CN2C3=CC=C(C=C3)C(=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O3/c1-15-20(21(26)25(23-15)18-6-3-2-4-7-18)14-19-8-5-13-24(19)17-11-9-16(10-12-17)22(27)28/h2-14H,1H3,(H,27,28)/p-1/b20-14-