O-[3-(3-methoxy-4-oxidanyl-phenyl)propyl] N-phenethylcarbamothioate

Systemtic Name: O-[3-(3-methoxy-4-oxidanyl-phenyl)propyl] N-phenethylcarbamothioate Openeye Name: O-[3-(4-hydroxy-3-methoxy-phenyl)propyl] N-phenethylcarbamothioate CAS Name: N-phenethylcarbamothioic acid O-[3-(4-hydroxy-3-methoxyphenyl)propyl] ester IUPAC Name: O-[3-(4-hydroxy-3-methoxyphenyl)propyl] N-phenethylcarbamothioate Traditional Name: N-phenethylthiocarbamic acid O-[3-(4-hydroxy-3-methoxy-phenyl)propyl] ester Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCCOC(=S)NCCC2=CC=CC=C2)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCCOC(=S)NCCC2=CC=CC=C2)O

InChI

InChI=1S/C19H23NO3S/c1-22-18-14-16(9-10-17(18)21)8-5-13-23-19(24)20-12-11-15-6-3-2-4-7-15/h2-4,6-7,9-10,14,21H,5,8,11-13H2,1H3,(H,20,24)