6-chloranyl-1-(3-methylbutyl)indole-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-(3-methylbutyl)indole-3-carboxylic acid Openeye Name: 6-chloro-1-isopentyl-indole-3-carboxylic acid CAS Name: 6-chloro-1-(3-methylbutyl)-3-indolecarboxylic acid IUPAC Name: 6-chloro-1-(3-methylbutyl)indole-3-carboxylic acid Traditional Name: 6-chloro-1-isoamyl-indole-3-carboxylic acid Formula: C14H16ClNO2 MolecularWeight: 265.73534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C2=C1C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC(C)CCN1C=C(C2=C1C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C14H16ClNO2/c1-9(2)5-6-16-8-12(14(17)18)11-4-3-10(15)7-13(11)16/h3-4,7-9H,5-6H2,1-2H3,(H,17,18)