1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxy-benzene

Systemtic Name: 1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxy-benzene Openeye Name: 1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxy-benzene CAS Name: 1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxybenzene IUPAC Name: 1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxybenzene Traditional Name: 1-[2-isothiocyanato-3-(4-methoxyphenyl)propyl]-4-methoxy-benzene Formula: C18H19NO2S MolecularWeight: 313.41396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CC2=CC=C(C=C2)OC)N=C=S

Isomeric SMILES

COC1=CC=C(C=C1)CC(CC2=CC=C(C=C2)OC)N=C=S

InChI

InChI=1S/C18H19NO2S/c1-20-17-7-3-14(4-8-17)11-16(19-13-22)12-15-5-9-18(21-2)10-6-15/h3-10,16H,11-12H2,1-2H3