2-(2-methoxycarbonyl-3-methyl-indol-3-yl)ethanoic acid

Systemtic Name: 2-(2-methoxycarbonyl-3-methyl-indol-3-yl)ethanoic acid Openeye Name: 2-(2-methoxycarbonyl-3-methyl-indol-3-yl)acetic acid CAS Name: 2-(2-methoxycarbonyl-3-methyl-3-indolyl)acetic acid IUPAC Name: 2-(2-methoxycarbonyl-3-methylindol-3-yl)acetic acid Traditional Name: 2-(2-carbomethoxy-3-methyl-indol-3-yl)acetic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N=C1C(=O)OC)CC(=O)O

Isomeric SMILES

CC1(C2=CC=CC=C2N=C1C(=O)OC)CC(=O)O

InChI

InChI=1S/C13H13NO4/c1-13(7-10(15)16)8-5-3-4-6-9(8)14-11(13)12(17)18-2/h3-6H,7H2,1-2H3,(H,15,16)