5-(2-methyl-3,4,5-triphenyl-pyrrol-1-yl)-3-oxidanylidene-pentanoic acid

Systemtic Name: 5-(2-methyl-3,4,5-triphenyl-pyrrol-1-yl)-3-oxidanylidene-pentanoic acid Openeye Name: 5-(2-methyl-3,4,5-triphenyl-pyrrol-1-yl)-3-oxo-pentanoic acid CAS Name: 5-(2-methyl-3,4,5-triphenyl-1-pyrrolyl)-3-oxopentanoic acid IUPAC Name: 5-(2-methyl-3,4,5-triphenylpyrrol-1-yl)-3-oxopentanoic acid Traditional Name: 3-keto-5-(2-methyl-3,4,5-triphenyl-pyrrol-1-yl)valeric acid Formula: C28H25NO3 MolecularWeight: 423.503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CCC(=O)CC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(N1CCC(=O)CC(=O)O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H25NO3/c1-20-26(21-11-5-2-6-12-21)27(22-13-7-3-8-14-22)28(23-15-9-4-10-16-23)29(20)18-17-24(30)19-25(31)32/h2-16H,17-19H2,1H3,(H,31,32)