(phenylmethyl) [4-[ethyl(2-hydroxyethyl)amino]phenyl]sulfanylmethanoate

Systemtic Name: (phenylmethyl) [4-[ethyl(2-hydroxyethyl)amino]phenyl]sulfanylmethanoate Openeye Name: benzyl [4-[ethyl(2-hydroxyethyl)amino]phenyl]sulfanylformate CAS Name: [[4-[ethyl(2-hydroxyethyl)amino]phenyl]thio]formic acid (phenylmethyl) ester IUPAC Name: benzyl [4-[ethyl(2-hydroxyethyl)amino]phenyl]sulfanylformate Traditional Name: [[4-[ethyl(2-hydroxyethyl)amino]phenyl]thio]formic acid benzyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=CC=C(C=C1)SC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCN(CCO)C1=CC=C(C=C1)SC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-2-19(12-13-20)16-8-10-17(11-9-16)23-18(21)22-14-15-6-4-3-5-7-15/h3-11,20H,2,12-14H2,1H3