prop-2-enyl 4-(4-hexylsulfanylphenoxy)-4-(propan-2-yldiazenyl)pentanoate

Systemtic Name: prop-2-enyl 4-(4-hexylsulfanylphenoxy)-4-(propan-2-yldiazenyl)pentanoate Openeye Name: allyl 4-(4-hexylsulfanylphenoxy)-4-isopropylazo-pentanoate CAS Name: 4-[4-(hexylthio)phenoxy]-4-propan-2-ylazopentanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(4-hexylsulfanylphenoxy)-4-(propan-2-yldiazenyl)pentanoate Traditional Name: 4-[4-(hexylthio)phenoxy]-4-isopropylazo-valeric acid allyl ester Formula: C23H36N2O3S MolecularWeight: 420.60854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=CC=C(C=C1)OC(C)(CCC(=O)OCC=C)N=NC(C)C

Isomeric SMILES

CCCCCCSC1=CC=C(C=C1)OC(C)(CCC(=O)OCC=C)N=NC(C)C

InChI

InChI=1S/C23H36N2O3S/c1-6-8-9-10-18-29-21-13-11-20(12-14-21)28-23(5,25-24-19(3)4)16-15-22(26)27-17-7-2/h7,11-14,19H,2,6,8-10,15-18H2,1,3-5H3