4-[2,5-dimethyl-3-(3-oxidanyl-2-oxidanylidene-3,3-diphenyl-propanehydrazonoyl)pyrrol-1-yl]benzoic acid

Systemtic Name: 4-[2,5-dimethyl-3-(3-oxidanyl-2-oxidanylidene-3,3-diphenyl-propanehydrazonoyl)pyrrol-1-yl]benzoic acid Openeye Name: 4-[3-(3-hydroxy-2-oxo-3,3-diphenyl-propanehydrazonoyl)-2,5-dimethyl-pyrrol-1-yl]benzoic acid CAS Name: 4-[3-[(1E)-1-hydrazinylidene-3-hydroxy-2-oxo-3,3-diphenylpropyl]-2,5-dimethyl-1-pyrrolyl]benzoic acid IUPAC Name: 4-[3-(3-hydroxy-2-oxo-3,3-diphenylpropanehydrazonoyl)-2,5-dimethylpyrrol-1-yl]benzoic acid Traditional Name: 4-[3-(3-hydroxy-2-keto-3,3-diphenyl-propanehydrazonoyl)-2,5-dimethyl-pyrrol-1-yl]benzoic acid Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)O)C)/C(=N\N)/C(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C28H25N3O4/c1-18-17-24(19(2)31(18)23-15-13-20(14-16-23)27(33)34)25(30-29)26(32)28(35,21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-17,35H,29H2,1-2H3,(H,33,34)/b30-25+