2-[1-[4-(1-benzofuran-2-ylmethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(1-benzofuran-2-ylmethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(benzofuran-2-ylmethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[[4-(2-benzofuranylmethoxy)phenyl]-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-[4-(1-benzofuran-2-ylmethoxy)benzoyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-[4-(benzofuran-2-ylmethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC5=CC=CC=C5O4)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC5=CC=CC=C5O4)CC(=O)O

InChI

InChI=1S/C27H21NO5/c1-17-13-23-19(15-26(29)30)6-4-7-24(23)28(17)27(31)18-9-11-21(12-10-18)32-16-22-14-20-5-2-3-8-25(20)33-22/h2-14H,15-16H2,1H3,(H,29,30)