2-chloranyl-1-(2-methylpropyl)indole-3-carboxylic acid

Systemtic Name: 2-chloranyl-1-(2-methylpropyl)indole-3-carboxylic acid Openeye Name: 2-chloro-1-isobutyl-indole-3-carboxylic acid CAS Name: 2-chloro-1-(2-methylpropyl)-3-indolecarboxylic acid IUPAC Name: 2-chloro-1-(2-methylpropyl)indole-3-carboxylic acid Traditional Name: 2-chloro-1-isobutyl-indole-3-carboxylic acid Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2C(=C1Cl)C(=O)O

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2C(=C1Cl)C(=O)O

InChI

InChI=1S/C13H14ClNO2/c1-8(2)7-15-10-6-4-3-5-9(10)11(12(15)14)13(16)17/h3-6,8H,7H2,1-2H3,(H,16,17)