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

Systemtic Name: 2-[1-[2-(diphenylmethyl)sulfanylethyl]indol-4-yl]oxyethanoate Openeye Name: 2-[1-(2-benzhydrylsulfanylethyl)indol-4-yl]oxyacetate CAS Name: 2-[[1-[2-[(diphenylmethyl)thio]ethyl]-4-indolyl]oxy]acetate IUPAC Name: 2-[1-(2-benzhydrylsulfanylethyl)indol-4-yl]oxyacetate Traditional Name: 2-[1-[2-(benzhydrylthio)ethyl]indol-4-yl]oxyacetate Formula: C25H22NO3S- MolecularWeight: 416.51208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN3C=CC4=C3C=CC=C4OCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCCN3C=CC4=C3C=CC=C4OCC(=O)[O-]

InChI

InChI=1S/C25H23NO3S/c27-24(28)18-29-23-13-7-12-22-21(23)14-15-26(22)16-17-30-25(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-15,25H,16-18H2,(H,27,28)/p-1