3-[4,6-bis(chloranyl)-2-ethoxycarbonyl-1H-indol-3-yl]-2-(3-methoxyphenyl)-3-oxidanyl-propanoic acid

Systemtic Name: 3-[4,6-bis(chloranyl)-2-ethoxycarbonyl-1H-indol-3-yl]-2-(3-methoxyphenyl)-3-oxidanyl-propanoic acid Openeye Name: 3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)-3-hydroxy-2-(3-methoxyphenyl)propanoic acid CAS Name: 3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)-3-hydroxy-2-(3-methoxyphenyl)propanoic acid IUPAC Name: 3-(4,6-dichloro-2-ethoxycarbonyl-1H-indol-3-yl)-3-hydroxy-2-(3-methoxyphenyl)propanoic acid Traditional Name: 3-(2-carbethoxy-4,6-dichloro-1H-indol-3-yl)-3-hydroxy-2-(3-methoxyphenyl)propionic acid Formula: C21H19Cl2NO6 MolecularWeight: 452.28466

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)C(C(C3=CC(=CC=C3)OC)C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2N1)Cl)Cl)C(C(C3=CC(=CC=C3)OC)C(=O)O)O

InChI

InChI=1S/C21H19Cl2NO6/c1-3-30-21(28)18-17(16-13(23)8-11(22)9-14(16)24-18)19(25)15(20(26)27)10-5-4-6-12(7-10)29-2/h4-9,15,19,24-25H,3H2,1-2H3,(H,26,27)