3,4-dimethoxy-5-methyl-[1]benzothiolo[2,3-c]quinolin-5-ium

Systemtic Name: 3,4-dimethoxy-5-methyl-[1]benzothiolo[2,3-c]quinolin-5-ium Openeye Name: 3,4-dimethoxy-5-methyl-benzothiopheno[2,3-c]quinolin-5-ium CAS Name: 3,4-dimethoxy-5-methyl-[1]benzothiolo[2,3-c]quinolin-5-ium IUPAC Name: 3,4-dimethoxy-5-methyl-[1]benzothiolo[2,3-c]quinolin-5-ium Traditional Name: 3,4-dimethoxy-5-methyl-benzothiopheno[2,3-c]quinolin-5-ium Formula: C18H16NO2S+ MolecularWeight: 310.39014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C3C4=CC=CC=C4SC3=C1)C=CC(=C2OC)OC

Isomeric SMILES

C[N+]1=C2C(=C3C4=CC=CC=C4SC3=C1)C=CC(=C2OC)OC

InChI

InChI=1S/C18H16NO2S/c1-19-10-15-16(11-6-4-5-7-14(11)22-15)12-8-9-13(20-2)18(21-3)17(12)19/h4-10H,1-3H3/q+1