3,3,7-trimethyl-9-sulfanyl-2,4-dihydroacridin-10-ium-1-one

Systemtic Name: 3,3,7-trimethyl-9-sulfanyl-2,4-dihydroacridin-10-ium-1-one Openeye Name: 3,3,7-trimethyl-9-sulfanyl-2,4-dihydroacridin-10-ium-1-one CAS Name: 9-mercapto-3,3,7-trimethyl-2,4-dihydroacridin-10-ium-1-one IUPAC Name: 3,3,7-trimethyl-9-sulfanyl-2,4-dihydroacridin-10-ium-1-one Traditional Name: 9-mercapto-3,3,7-trimethyl-2,4-dihydroacridin-10-ium-1-one Formula: C16H18NOS+ MolecularWeight: 272.38522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[NH+]=C3CC(CC(=O)C3=C2S)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)[NH+]=C3CC(CC(=O)C3=C2S)(C)C

InChI

InChI=1S/C16H17NOS/c1-9-4-5-11-10(6-9)15(19)14-12(17-11)7-16(2,3)8-13(14)18/h4-6H,7-8H2,1-3H3,(H,17,19)/p+1