4-[5-(5-methyl-7-prop-1-en-2-yl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid

Systemtic Name: 4-[5-(5-methyl-7-prop-1-en-2-yl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Openeye Name: 4-[5-(7-isopropenyl-5-methyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid CAS Name: 4-[5-[5-methyl-7-(1-methylethenyl)-2-benzofuranyl]-1H-pyrrol-2-yl]benzoic acid IUPAC Name: 4-[5-(5-methyl-7-prop-1-en-2-yl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Traditional Name: 4-[5-(7-isopropenyl-5-methyl-benzofuran-2-yl)-1H-pyrrol-2-yl]benzoic acid Formula: C23H19NO3 MolecularWeight: 357.40186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO3/c1-13(2)18-11-14(3)10-17-12-21(27-22(17)18)20-9-8-19(24-20)15-4-6-16(7-5-15)23(25)26/h4-12,24H,1H2,2-3H3,(H,25,26)