2H-benzotriazol-5-yl 2-[(4-ethenylphenyl)methylsulfanyl]ethanoate

Systemtic Name: 2H-benzotriazol-5-yl 2-[(4-ethenylphenyl)methylsulfanyl]ethanoate Openeye Name: 2H-benzotriazol-5-yl 2-[(4-vinylphenyl)methylsulfanyl]acetate CAS Name: 2-[(4-ethenylphenyl)methylthio]acetic acid 2H-benzotriazol-5-yl ester IUPAC Name: 2H-benzotriazol-5-yl 2-[(4-ethenylphenyl)methylsulfanyl]acetate Traditional Name: 2-[(4-vinylbenzyl)thio]acetic acid 2H-benzotriazol-5-yl ester Formula: C17H15N3O2S MolecularWeight: 325.3849

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)CSCC(=O)OC2=CC3=NNN=C3C=C2

Isomeric SMILES

C=CC1=CC=C(C=C1)CSCC(=O)OC2=CC3=NNN=C3C=C2

InChI

InChI=1S/C17H15N3O2S/c1-2-12-3-5-13(6-4-12)10-23-11-17(21)22-14-7-8-15-16(9-14)19-20-18-15/h2-9H,1,10-11H2,(H,18,19,20)