methyl 2-[1-[2-(diphenylmethyl)sulfanylethyl]indol-4-yl]oxyethanoate

Systemtic Name: methyl 2-[1-[2-(diphenylmethyl)sulfanylethyl]indol-4-yl]oxyethanoate Openeye Name: methyl 2-[1-(2-benzhydrylsulfanylethyl)indol-4-yl]oxyacetate CAS Name: 2-[[1-[2-[(diphenylmethyl)thio]ethyl]-4-indolyl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[1-(2-benzhydrylsulfanylethyl)indol-4-yl]oxyacetate Traditional Name: 2-[1-[2-(benzhydrylthio)ethyl]indol-4-yl]oxyacetic acid methyl ester Formula: C26H25NO3S MolecularWeight: 431.5466

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC2=C1C=CN2CCSC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)COC1=CC=CC2=C1C=CN2CCSC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25NO3S/c1-29-25(28)19-30-24-14-8-13-23-22(24)15-16-27(23)17-18-31-26(20-9-4-2-5-10-20)21-11-6-3-7-12-21/h2-16,26H,17-19H2,1H3