6-[5-(4,5,7-trimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid

Systemtic Name: 6-[5-(4,5,7-trimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid Openeye Name: 6-[5-(4,5,7-trimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid CAS Name: 6-[5-(4,5,7-trimethyl-2-benzofuranyl)-1H-pyrrol-2-yl]-2-naphthalenecarboxylic acid IUPAC Name: 6-[5-(4,5,7-trimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]naphthalene-2-carboxylic acid Traditional Name: 6-[5-(4,5,7-trimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]-2-naphthoic acid Formula: C26H21NO3 MolecularWeight: 395.44984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1C)C=C(O2)C3=CC=C(N3)C4=CC5=C(C=C4)C=C(C=C5)C(=O)O)C

Isomeric SMILES

CC1=CC(=C2C(=C1C)C=C(O2)C3=CC=C(N3)C4=CC5=C(C=C4)C=C(C=C5)C(=O)O)C

InChI

InChI=1S/C26H21NO3/c1-14-10-15(2)25-21(16(14)3)13-24(30-25)23-9-8-22(27-23)19-6-4-18-12-20(26(28)29)7-5-17(18)11-19/h4-13,27H,1-3H3,(H,28,29)