5-chloranyl-1-methyl-3-propan-2-yl-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-1-methyl-3-propan-2-yl-indole-2-carboxylic acid Openeye Name: 5-chloro-3-isopropyl-1-methyl-indole-2-carboxylic acid CAS Name: 5-chloro-1-methyl-3-propan-2-yl-2-indolecarboxylic acid IUPAC Name: 5-chloro-1-methyl-3-propan-2-ylindole-2-carboxylic acid Traditional Name: 5-chloro-3-isopropyl-1-methyl-indole-2-carboxylic acid Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C2=C1C=C(C=C2)Cl)C)C(=O)O

Isomeric SMILES

CC(C)C1=C(N(C2=C1C=C(C=C2)Cl)C)C(=O)O

InChI

InChI=1S/C13H14ClNO2/c1-7(2)11-9-6-8(14)4-5-10(9)15(3)12(11)13(16)17/h4-7H,1-3H3,(H,16,17)