3-(2,3,4-trimethoxycyclohexa-1,3-dien-1-yl)-1-benzothiophene

Systemtic Name: 3-(2,3,4-trimethoxycyclohexa-1,3-dien-1-yl)-1-benzothiophene Openeye Name: 3-(2,3,4-trimethoxycyclohexa-1,3-dien-1-yl)benzothiophene CAS Name: 3-(2,3,4-trimethoxy-1-cyclohexa-1,3-dienyl)-1-benzothiophene IUPAC Name: 3-(2,3,4-trimethoxycyclohexa-1,3-dien-1-yl)-1-benzothiophene Traditional Name: 3-(2,3,4-trimethoxycyclohexa-1,3-dien-1-yl)benzothiophene Formula: C17H18O3S MolecularWeight: 302.38802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(CC1)C2=CSC3=CC=CC=C32)OC)OC

Isomeric SMILES

COC1=C(C(=C(CC1)C2=CSC3=CC=CC=C32)OC)OC

InChI

InChI=1S/C17H18O3S/c1-18-14-9-8-12(16(19-2)17(14)20-3)13-10-21-15-7-5-4-6-11(13)15/h4-7,10H,8-9H2,1-3H3