1-(2-chlorophenyl)carbonyl-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylic acid

Systemtic Name: 1-(2-chlorophenyl)carbonyl-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylic acid Openeye Name: 1-(2-chlorobenzoyl)-3-(2-methylpropanoyl)-2-propyl-indole-6-carboxylic acid CAS Name: 1-[(2-chlorophenyl)-oxomethyl]-3-(2-methyl-1-oxopropyl)-2-propyl-6-indolecarboxylic acid IUPAC Name: 1-(2-chlorobenzoyl)-3-(2-methylpropanoyl)-2-propylindole-6-carboxylic acid Traditional Name: 1-(2-chlorobenzoyl)-3-isobutyryl-2-propyl-indole-6-carboxylic acid Formula: C23H22ClNO4 MolecularWeight: 411.87808

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(N1C(=O)C3=CC=CC=C3Cl)C=C(C=C2)C(=O)O)C(=O)C(C)C

Isomeric SMILES

CCCC1=C(C2=C(N1C(=O)C3=CC=CC=C3Cl)C=C(C=C2)C(=O)O)C(=O)C(C)C

InChI

InChI=1S/C23H22ClNO4/c1-4-7-18-20(21(26)13(2)3)16-11-10-14(23(28)29)12-19(16)25(18)22(27)15-8-5-6-9-17(15)24/h5-6,8-13H,4,7H2,1-3H3,(H,28,29)