4-[2,5-dimethyl-3-[(E)-(phenylcarbonylhydrazinylidene)methyl]pyrrol-1-yl]-3-methyl-benzoic acid

Systemtic Name: 4-[2,5-dimethyl-3-[(E)-(phenylcarbonylhydrazinylidene)methyl]pyrrol-1-yl]-3-methyl-benzoic acid Openeye Name: 4-[3-[(E)-(benzoylhydrazono)methyl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-benzoic acid CAS Name: 4-[3-[(E)-(benzoylhydrazinylidene)methyl]-2,5-dimethyl-1-pyrrolyl]-3-methylbenzoic acid IUPAC Name: 4-[3-[(E)-(benzoylhydrazinylidene)methyl]-2,5-dimethylpyrrol-1-yl]-3-methylbenzoic acid Traditional Name: 4-[3-[(E)-(benzoylhydrazono)methyl]-2,5-dimethyl-pyrrol-1-yl]-3-methyl-benzoic acid Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=C(C=C2)C(=O)O)C)C)C=NNC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=C(C=C2)C(=O)O)C)C)/C=N/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3/c1-14-11-18(22(27)28)9-10-20(14)25-15(2)12-19(16(25)3)13-23-24-21(26)17-7-5-4-6-8-17/h4-13H,1-3H3,(H,24,26)(H,27,28)/b23-13+