4-[1-(3-methylbutyl)indol-3-yl]butanoic acid

Systemtic Name: 4-[1-(3-methylbutyl)indol-3-yl]butanoic acid Openeye Name: 4-(1-isopentylindol-3-yl)butanoic acid CAS Name: 4-[1-(3-methylbutyl)-3-indolyl]butanoic acid IUPAC Name: 4-[1-(3-methylbutyl)indol-3-yl]butanoic acid Traditional Name: 4-(1-isoamylindol-3-yl)butyric acid Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(C2=CC=CC=C21)CCCC(=O)O

Isomeric SMILES

CC(C)CCN1C=C(C2=CC=CC=C21)CCCC(=O)O

InChI

InChI=1S/C17H23NO2/c1-13(2)10-11-18-12-14(6-5-9-17(19)20)15-7-3-4-8-16(15)18/h3-4,7-8,12-13H,5-6,9-11H2,1-2H3,(H,19,20)