4,6-bis(chloranyl)-3-[(Z)-3-oxidanyl-3-oxidanylidene-2-thiophen-2-yl-prop-1-enyl]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-[(Z)-3-oxidanyl-3-oxidanylidene-2-thiophen-2-yl-prop-1-enyl]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-[(Z)-3-hydroxy-3-oxo-2-(2-thienyl)prop-1-enyl]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-[(Z)-3-hydroxy-3-oxo-2-thiophen-2-ylprop-1-enyl]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-[(Z)-3-hydroxy-3-oxo-2-thiophen-2-ylprop-1-enyl]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-[(Z)-3-hydroxy-3-keto-2-(2-thienyl)prop-1-enyl]-1H-indole-2-carboxylic acid Formula: C16H9Cl2NO4S MolecularWeight: 382.21796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=CC2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CSC(=C1)/C(=C\C2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)O)/C(=O)O

InChI

InChI=1S/C16H9Cl2NO4S/c17-7-4-10(18)13-9(14(16(22)23)19-11(13)5-7)6-8(15(20)21)12-2-1-3-24-12/h1-6,19H,(H,20,21)(H,22,23)/b8-6+