2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]-methoxycarbonyl-amino]-5-methyl-benzoic acid

Systemtic Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]-methoxycarbonyl-amino]-5-methyl-benzoic acid Openeye Name: 2-[[5-(4-fluorophenyl)benzofuran-2-yl]-methoxycarbonyl-amino]-5-methyl-benzoic acid CAS Name: 2-[[5-(4-fluorophenyl)-2-benzofuranyl]-methoxycarbonylamino]-5-methylbenzoic acid IUPAC Name: 2-[[5-(4-fluorophenyl)-1-benzofuran-2-yl]-methoxycarbonylamino]-5-methylbenzoic acid Traditional Name: 2-[carbomethoxy-[5-(4-fluorophenyl)benzofuran-2-yl]amino]-5-methyl-benzoic acid Formula: C24H18FNO5 MolecularWeight: 419.401823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N(C2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)F)C(=O)OC)C(=O)O

InChI

InChI=1S/C24H18FNO5/c1-14-3-9-20(19(11-14)23(27)28)26(24(29)30-2)22-13-17-12-16(6-10-21(17)31-22)15-4-7-18(25)8-5-15/h3-13H,1-2H3,(H,27,28)