4,6-bis(chloranyl)-3-[3-(dimethylamino)-3-oxidanylidene-propyl]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-[3-(dimethylamino)-3-oxidanylidene-propyl]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-[3-(dimethylamino)-3-oxo-propyl]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-[3-(dimethylamino)-3-oxopropyl]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-[3-(dimethylamino)-3-oxopropyl]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-[3-(dimethylamino)-3-keto-propyl]-1H-indole-2-carboxylic acid Formula: C14H14Cl2N2O3 MolecularWeight: 329.17856

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O

Isomeric SMILES

CN(C)C(=O)CCC1=C(NC2=CC(=CC(=C21)Cl)Cl)C(=O)O

InChI

InChI=1S/C14H14Cl2N2O3/c1-18(2)11(19)4-3-8-12-9(16)5-7(15)6-10(12)17-13(8)14(20)21/h5-6,17H,3-4H2,1-2H3,(H,20,21)