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

Systemtic Name: 1-methyl-3-(2-methylpropyl)indole-2-carboxylic acid Openeye Name: 3-isobutyl-1-methyl-indole-2-carboxylic acid CAS Name: 1-methyl-3-(2-methylpropyl)-2-indolecarboxylic acid IUPAC Name: 1-methyl-3-(2-methylpropyl)indole-2-carboxylic acid Traditional Name: 3-isobutyl-1-methyl-indole-2-carboxylic acid Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N(C2=CC=CC=C21)C)C(=O)O

Isomeric SMILES

CC(C)CC1=C(N(C2=CC=CC=C21)C)C(=O)O

InChI

InChI=1S/C14H17NO2/c1-9(2)8-11-10-6-4-5-7-12(10)15(3)13(11)14(16)17/h4-7,9H,8H2,1-3H3,(H,16,17)