2-[1-[(4-chlorophenyl)diazenyl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-3-carboxylic acid

Systemtic Name: 2-[1-[(4-chlorophenyl)diazenyl]-2-oxidanyl-2-oxidanylidene-ethyl]-1-methyl-indole-3-carboxylic acid Openeye Name: 2-[1-(4-chlorophenyl)azo-2-hydroxy-2-oxo-ethyl]-1-methyl-indole-3-carboxylic acid CAS Name: 2-[1-(4-chlorophenyl)azo-2-hydroxy-2-oxoethyl]-1-methyl-3-indolecarboxylic acid IUPAC Name: 2-[1-[(4-chlorophenyl)diazenyl]-2-hydroxy-2-oxoethyl]-1-methylindole-3-carboxylic acid Traditional Name: 2-[1-(4-chlorophenyl)azo-2-hydroxy-2-keto-ethyl]-1-methyl-indole-3-carboxylic acid Formula: C18H14ClN3O4 MolecularWeight: 371.77446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1C(C(=O)O)N=NC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1C(C(=O)O)N=NC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H14ClN3O4/c1-22-13-5-3-2-4-12(13)14(17(23)24)16(22)15(18(25)26)21-20-11-8-6-10(19)7-9-11/h2-9,15H,1H3,(H,23,24)(H,25,26)