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

Systemtic Name: [4-[2,5-dimethyl-3-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]phenyl] ethanoate Openeye Name: [4-[2,5-dimethyl-3-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]pyrrol-1-yl]phenyl] acetate CAS Name: acetic acid [4-[2,5-dimethyl-3-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]-1-pyrrolyl]phenyl] ester IUPAC Name: [4-[2,5-dimethyl-3-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]pyrrol-1-yl]phenyl] acetate Traditional Name: acetic acid [4-[3-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]-2,5-dimethyl-pyrrol-1-yl]phenyl] ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC(=O)C)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC(=O)C)C)C=C3C(=NN(C3=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O3/c1-16-14-20(18(3)27(16)21-10-12-23(13-11-21)31-19(4)29)15-24-17(2)26-28(25(24)30)22-8-6-5-7-9-22/h5-15H,1-4H3