3-[3-oxidanylidene-4-(2-trimethylsilylethoxymethyl)quinoxalin-2-yl]-2-(phenylmethylsulfanyl)benzoic acid

Systemtic Name: 3-[3-oxidanylidene-4-(2-trimethylsilylethoxymethyl)quinoxalin-2-yl]-2-(phenylmethylsulfanyl)benzoic acid Openeye Name: 2-benzylsulfanyl-3-[3-oxo-4-(2-trimethylsilylethoxymethyl)quinoxalin-2-yl]benzoic acid CAS Name: 3-[3-oxo-4-(2-trimethylsilylethoxymethyl)-2-quinoxalinyl]-2-(phenylmethylthio)benzoic acid IUPAC Name: 2-benzylsulfanyl-3-[3-oxo-4-(2-trimethylsilylethoxymethyl)quinoxalin-2-yl]benzoic acid Traditional Name: 2-(benzylthio)-3-[3-keto-4-(2-trimethylsilylethoxymethyl)quinoxalin-2-yl]benzoic acid Formula: C28H30N2O4SSi MolecularWeight: 518.6993

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)CCOCN1C2=CC=CC=C2N=C(C1=O)C3=C(C(=CC=C3)C(=O)O)SCC4=CC=CC=C4

Isomeric SMILES

C[Si](C)(C)CCOCN1C2=CC=CC=C2N=C(C1=O)C3=C(C(=CC=C3)C(=O)O)SCC4=CC=CC=C4

InChI

InChI=1S/C28H30N2O4SSi/c1-36(2,3)17-16-34-19-30-24-15-8-7-14-23(24)29-25(27(30)31)21-12-9-13-22(28(32)33)26(21)35-18-20-10-5-4-6-11-20/h4-15H,16-19H2,1-3H3,(H,32,33)