2-ethoxycarbonyl-1-(2-methylpropyl)indole-5-carboxylic acid

Systemtic Name: 2-ethoxycarbonyl-1-(2-methylpropyl)indole-5-carboxylic acid Openeye Name: 2-ethoxycarbonyl-1-isobutyl-indole-5-carboxylic acid CAS Name: 2-ethoxycarbonyl-1-(2-methylpropyl)-5-indolecarboxylic acid IUPAC Name: 2-ethoxycarbonyl-1-(2-methylpropyl)indole-5-carboxylic acid Traditional Name: 2-carbethoxy-1-isobutyl-indole-5-carboxylic acid Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1CC(C)C)C=CC(=C2)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1CC(C)C)C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H19NO4/c1-4-21-16(20)14-8-12-7-11(15(18)19)5-6-13(12)17(14)9-10(2)3/h5-8,10H,4,9H2,1-3H3,(H,18,19)