2-ethoxycarbonyl-3-methyl-indole-1-carboxylic acid

Systemtic Name: 2-ethoxycarbonyl-3-methyl-indole-1-carboxylic acid Openeye Name: 2-ethoxycarbonyl-3-methyl-indole-1-carboxylic acid CAS Name: 2-ethoxycarbonyl-3-methyl-1-indolecarboxylic acid IUPAC Name: 2-ethoxycarbonyl-3-methylindole-1-carboxylic acid Traditional Name: 2-carbethoxy-3-methyl-indole-1-carboxylic acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N1C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N1C(=O)O)C

InChI

InChI=1S/C13H13NO4/c1-3-18-12(15)11-8(2)9-6-4-5-7-10(9)14(11)13(16)17/h4-7H,3H2,1-2H3,(H,16,17)