4-[5-(2,3,4,7-tetramethyl-1-benzofuran-5-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(2,3,4,7-tetramethyl-1-benzofuran-5-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(2,3,4,7-tetramethylbenzofuran-5-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-(2,3,4,7-tetramethyl-5-benzofuranyl)-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(2,3,4,7-tetramethyl-1-benzofuran-5-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(2,3,4,7-tetramethylbenzofuran-5-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C23H21NO3 MolecularWeight: 359.41774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)C)C(=C(O2)C)C

Isomeric SMILES

CC1=C2C(=C(C(=C1)C3=CC=C(N3)C4=CC=C(C=C4)C(=O)O)C)C(=C(O2)C)C

InChI

InChI=1S/C23H21NO3/c1-12-11-18(14(3)21-13(2)15(4)27-22(12)21)20-10-9-19(24-20)16-5-7-17(8-6-16)23(25)26/h5-11,24H,1-4H3,(H,25,26)