2-(3-methylbutyl)-1H-indole-5-carboxylic acid

Systemtic Name: 2-(3-methylbutyl)-1H-indole-5-carboxylic acid Openeye Name: 2-isopentyl-1H-indole-5-carboxylic acid CAS Name: 2-(3-methylbutyl)-1H-indole-5-carboxylic acid IUPAC Name: 2-(3-methylbutyl)-1H-indole-5-carboxylic acid Traditional Name: 2-isoamyl-1H-indole-5-carboxylic acid Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC2=C(N1)C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)CCC1=CC2=C(N1)C=CC(=C2)C(=O)O

InChI

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