aminocarbonyl-[6-(5-bromanylthiophen-2-yl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-azanium

Systemtic Name: aminocarbonyl-[6-(5-bromanylthiophen-2-yl)-1-methoxy-6H-benzo[c]chromen-8-yl]-dimethyl-azanium Openeye Name: [6-(5-bromo-2-thienyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-carbamoyl-dimethyl-ammonium CAS Name: [6-(5-bromo-2-thiophenyl)-1-methoxy-6H-benzo[c][1]benzopyran-8-yl]-carbamoyl-dimethylammonium IUPAC Name: [6-(5-bromothiophen-2-yl)-1-methoxy-6H-benzo[c]chromen-8-yl]-carbamoyl-dimethylazanium Traditional Name: [6-(5-bromo-2-thienyl)-1-methoxy-6H-benzo[c]chromen-8-yl]-carbamoyl-dimethyl-ammonium Formula: C21H20BrN2O3S+ MolecularWeight: 460.3641

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC2=C(C=C1)C3=C(C=CC=C3OC)OC2C4=CC=C(S4)Br)C(=O)N

Isomeric SMILES

C[N+](C)(C1=CC2=C(C=C1)C3=C(C=CC=C3OC)OC2C4=CC=C(S4)Br)C(=O)N

InChI

InChI=1S/C21H19BrN2O3S/c1-24(2,21(23)25)12-7-8-13-14(11-12)20(17-9-10-18(22)28-17)27-16-6-4-5-15(26-3)19(13)16/h4-11,20H,1-3H3,(H-,23,25)/p+1