3-[(2,4-dichlorophenyl)methyl]-1-methyl-indole-5-carboxylic acid

Systemtic Name: 3-[(2,4-dichlorophenyl)methyl]-1-methyl-indole-5-carboxylic acid Openeye Name: 3-[(2,4-dichlorophenyl)methyl]-1-methyl-indole-5-carboxylic acid CAS Name: 3-[(2,4-dichlorophenyl)methyl]-1-methyl-5-indolecarboxylic acid IUPAC Name: 3-[(2,4-dichlorophenyl)methyl]-1-methylindole-5-carboxylic acid Traditional Name: 3-(2,4-dichlorobenzyl)-1-methyl-indole-5-carboxylic acid Formula: C17H13Cl2NO2 MolecularWeight: 334.19662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)C(=O)O)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2NO2/c1-20-9-12(6-10-2-4-13(18)8-15(10)19)14-7-11(17(21)22)3-5-16(14)20/h2-5,7-9H,6H2,1H3,(H,21,22)