1-(2,2-diethylbutanoyl)-3-methyl-indole-7-carboxylic acid

Systemtic Name: 1-(2,2-diethylbutanoyl)-3-methyl-indole-7-carboxylic acid Openeye Name: 1-(2,2-diethylbutanoyl)-3-methyl-indole-7-carboxylic acid CAS Name: 1-(2,2-diethyl-1-oxobutyl)-3-methyl-7-indolecarboxylic acid IUPAC Name: 1-(2,2-diethylbutanoyl)-3-methylindole-7-carboxylic acid Traditional Name: 1-(2,2-diethylbutanoyl)-3-methyl-indole-7-carboxylic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC)C(=O)N1C=C(C2=C1C(=CC=C2)C(=O)O)C

Isomeric SMILES

CCC(CC)(CC)C(=O)N1C=C(C2=C1C(=CC=C2)C(=O)O)C

InChI

InChI=1S/C18H23NO3/c1-5-18(6-2,7-3)17(22)19-11-12(4)13-9-8-10-14(15(13)19)16(20)21/h8-11H,5-7H2,1-4H3,(H,20,21)