4,6-bis(chloranyl)-2-(2,4-dichlorophenyl)-3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-2-(2,4-dichlorophenyl)-3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)indole-2-carboxylic acid Openeye Name: 3-(1-carboxyvinyl)-4,6-dichloro-2-(2,4-dichlorophenyl)indole-2-carboxylic acid CAS Name: 4,6-dichloro-2-(2,4-dichlorophenyl)-3-(3-hydroxy-3-oxoprop-1-en-2-yl)-2-indolecarboxylic acid IUPAC Name: 4,6-dichloro-2-(2,4-dichlorophenyl)-3-(3-hydroxy-3-oxoprop-1-en-2-yl)indole-2-carboxylic acid Traditional Name: 3-(1-carboxyvinyl)-4,6-dichloro-2-(2,4-dichlorophenyl)indole-2-carboxylic acid Formula: C18H9Cl4NO4 MolecularWeight: 445.08036

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C2C(=CC(=CC2=NC1(C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Cl)Cl)C(=O)O

Isomeric SMILES

C=C(C1=C2C(=CC(=CC2=NC1(C3=C(C=C(C=C3)Cl)Cl)C(=O)O)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H9Cl4NO4/c1-7(16(24)25)15-14-12(22)5-9(20)6-13(14)23-18(15,17(26)27)10-3-2-8(19)4-11(10)21/h2-6H,1H2,(H,24,25)(H,26,27)