2-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid

Systemtic Name: 2-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]carbonyl-2-methyl-indol-4-yl]ethanoic acid Openeye Name: 2-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid CAS Name: 2-[1-[[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)phenyl]-oxomethyl]-2-methyl-4-indolyl]acetic acid IUPAC Name: 2-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)benzoyl]-2-methylindol-4-yl]acetic acid Traditional Name: 2-[1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethoxy)benzoyl]-2-methyl-indol-4-yl]acetic acid Formula: C27H23NO6 MolecularWeight: 457.47462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC5=C(C=C4)OCCO5)CC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC=C2N1C(=O)C3=CC=C(C=C3)OCC4=CC5=C(C=C4)OCCO5)CC(=O)O

InChI

InChI=1S/C27H23NO6/c1-17-13-22-20(15-26(29)30)3-2-4-23(22)28(17)27(31)19-6-8-21(9-7-19)34-16-18-5-10-24-25(14-18)33-12-11-32-24/h2-10,13-14H,11-12,15-16H2,1H3,(H,29,30)