octyl 2-[[3-azanyl-4-(2-hydroxyethyloxy)phenyl]-(2-octoxy-2-oxidanylidene-ethyl)sulfanyl-arsanyl]sulfanylethanoate

Systemtic Name: octyl 2-[[3-azanyl-4-(2-hydroxyethyloxy)phenyl]-(2-octoxy-2-oxidanylidene-ethyl)sulfanyl-arsanyl]sulfanylethanoate Openeye Name: octyl 2-[[3-amino-4-(2-hydroxyethoxy)phenyl]-(2-octoxy-2-oxo-ethyl)sulfanyl-arsanyl]sulfanylacetate CAS Name: 2-[[[3-amino-4-(2-hydroxyethoxy)phenyl]-[(2-octoxy-2-oxoethyl)thio]arsino]thio]acetic acid octyl ester IUPAC Name: octyl 2-[[3-amino-4-(2-hydroxyethoxy)phenyl]-(2-octoxy-2-oxoethyl)sulfanylarsanyl]sulfanylacetate Traditional Name: 2-[[[3-amino-4-(2-hydroxyethoxy)phenyl]-[(2-keto-2-octoxy-ethyl)thio]arsino]thio]acetic acid octyl ester Formula: C28H48AsNO6S2 MolecularWeight: 633.73542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CS[As](C1=CC(=C(C=C1)OCCO)N)SCC(=O)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOC(=O)CS[As](C1=CC(=C(C=C1)OCCO)N)SCC(=O)OCCCCCCCC

InChI

InChI=1S/C28H48AsNO6S2/c1-3-5-7-9-11-13-18-35-27(32)22-37-29(24-15-16-26(25(30)21-24)34-20-17-31)38-23-28(33)36-19-14-12-10-8-6-4-2/h15-16,21,31H,3-14,17-20,22-23,30H2,1-2H3