1-(3-methylbutanoyl)-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-(3-methylbutanoyl)-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-(3-methylbutanoyl)indoline-2-carboxylic acid CAS Name: 1-(3-methyl-1-oxobutyl)-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-(3-methylbutanoyl)-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-isovalerylindoline-2-carboxylic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)CC(=O)N1C(CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C14H17NO3/c1-9(2)7-13(16)15-11-6-4-3-5-10(11)8-12(15)14(17)18/h3-6,9,12H,7-8H2,1-2H3,(H,17,18)