carbamothioyl-[6-(3-fluorophenyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-azanium

Systemtic Name: carbamothioyl-[6-(3-fluorophenyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-azanium Openeye Name: carbamothioyl-[6-(3-fluorophenyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-ammonium CAS Name: carbamothioyl-[6-(3-fluorophenyl)-1-methoxy-6H-benzo[c][1]benzopyran-8-yl]-dimethylammonium IUPAC Name: carbamothioyl-[6-(3-fluorophenyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethylazanium Traditional Name: [6-(3-fluorophenyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-thiocarbamoyl-ammonium Formula: C23H22FN2O2S+ MolecularWeight: 409.496383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC2=C(C=C1)C3=C(C=CC=C3OC)OC2C4=CC(=CC=C4)F)C(=S)N

Isomeric SMILES

C[N+](C)(C1=CC2=C(C=C1)C3=C(C=CC=C3OC)OC2C4=CC(=CC=C4)F)C(=S)N

InChI

InChI=1S/C23H21FN2O2S/c1-26(2,23(25)29)16-10-11-17-18(13-16)22(14-6-4-7-15(24)12-14)28-20-9-5-8-19(27-3)21(17)20/h4-13,22H,1-3H3,(H-,25,29)/p+1