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

Systemtic Name: 4,6-bis(chloranyl)-3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)-2-pyridin-3-yl-indole-2-carboxylic acid Openeye Name: 3-(1-carboxyvinyl)-4,6-dichloro-2-(3-pyridyl)indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-(3-hydroxy-3-oxoprop-1-en-2-yl)-2-(3-pyridinyl)-2-indolecarboxylic acid IUPAC Name: 4,6-dichloro-3-(3-hydroxy-3-oxoprop-1-en-2-yl)-2-pyridin-3-ylindole-2-carboxylic acid Traditional Name: 3-(1-carboxyvinyl)-4,6-dichloro-2-(3-pyridyl)indole-2-carboxylic acid Formula: C17H10Cl2N2O4 MolecularWeight: 377.1783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H10Cl2N2O4/c1-8(15(22)23)14-13-11(19)5-10(18)6-12(13)21-17(14,16(24)25)9-3-2-4-20-7-9/h2-7H,1H2,(H,22,23)(H,24,25)