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

Systemtic Name: 4-[5-(4,7-dimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]-3-methoxy-benzoic acid Openeye Name: 4-[5-(4,7-dimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]-3-methoxy-benzoic acid CAS Name: 4-[5-(4,7-dimethyl-2-benzofuranyl)-1H-pyrrol-2-yl]-3-methoxybenzoic acid IUPAC Name: 4-[5-(4,7-dimethyl-1-benzofuran-2-yl)-1H-pyrrol-2-yl]-3-methoxybenzoic acid Traditional Name: 4-[5-(4,7-dimethylbenzofuran-2-yl)-1H-pyrrol-2-yl]-3-methoxy-benzoic acid Formula: C22H19NO4 MolecularWeight: 361.39056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(OC2=C(C=C1)C)C3=CC=C(N3)C4=C(C=C(C=C4)C(=O)O)OC

Isomeric SMILES

CC1=C2C=C(OC2=C(C=C1)C)C3=CC=C(N3)C4=C(C=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C22H19NO4/c1-12-4-5-13(2)21-16(12)11-20(27-21)18-9-8-17(23-18)15-7-6-14(22(24)25)10-19(15)26-3/h4-11,23H,1-3H3,(H,24,25)