4-[3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[3-[2-(4-chloro-3-methyl-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[3-[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[3-[2-(4-chloro-3-methylphenoxy)acetyl]-2,5-dimethylpyrrol-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[3-[2-(4-chloro-3-methyl-phenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C(=O)COC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(N1C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C)C(=O)COC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C26H26ClN3O3/c1-16-13-21(11-12-23(16)27)33-15-24(31)22-14-17(2)29(18(22)3)25-19(4)28(5)30(26(25)32)20-9-7-6-8-10-20/h6-14H,15H2,1-5H3