4-[(6-chloranyl-2-oxidanylidene-3H-indol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(6-chloranyl-2-oxidanylidene-3H-indol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(6-chloro-2-oxo-indolin-1-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(6-chloro-2-oxo-3H-indol-1-yl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(6-chloro-2-oxo-3H-indol-1-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(6-chloro-2-keto-indolin-1-yl)methyl]thiazole-2-carboxylic acid Formula: C13H9ClN2O3S MolecularWeight: 308.74016

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)Cl)N(C1=O)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1C2=C(C=C(C=C2)Cl)N(C1=O)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C13H9ClN2O3S/c14-8-2-1-7-3-11(17)16(10(7)4-8)5-9-6-20-12(15-9)13(18)19/h1-2,4,6H,3,5H2,(H,18,19)