2-diethylaminoethyl 2-hexylsulfanyl-2,2-diphenyl-ethanoate

Systemtic Name: 2-diethylaminoethyl 2-hexylsulfanyl-2,2-diphenyl-ethanoate Openeye Name: 2-diethylaminoethyl 2-hexylsulfanyl-2,2-diphenyl-acetate CAS Name: 2-(hexylthio)-2,2-diphenylacetic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2-hexylsulfanyl-2,2-diphenylacetate Traditional Name: 2-(hexylthio)-2,2-diphenyl-acetic acid 2-diethylaminoethyl ester Formula: C26H37NO2S MolecularWeight: 427.64248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC

Isomeric SMILES

CCCCCCSC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC

InChI

InChI=1S/C26H37NO2S/c1-4-7-8-15-22-30-26(23-16-11-9-12-17-23,24-18-13-10-14-19-24)25(28)29-21-20-27(5-2)6-3/h9-14,16-19H,4-8,15,20-22H2,1-3H3