2-[6-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[6-chloro-2-[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[6-chloro-2-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[6-chloro-2-(2,3-dihydro-1,4-benzodioxin-6-carbonyl)-1H-indol-3-yl]acetic acid Formula: C19H14ClNO5 MolecularWeight: 371.77116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C3=C(C4=C(N3)C=C(C=C4)Cl)CC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)C3=C(C4=C(N3)C=C(C=C4)Cl)CC(=O)O

InChI

InChI=1S/C19H14ClNO5/c20-11-2-3-12-13(9-17(22)23)18(21-14(12)8-11)19(24)10-1-4-15-16(7-10)26-6-5-25-15/h1-4,7-8,21H,5-6,9H2,(H,22,23)