2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbothioylamino]ethyl-trimethyl-azanium

Systemtic Name: 2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbothioylamino]ethyl-trimethyl-azanium Openeye Name: 2-[(8-methoxy-2-oxo-chromene-3-carbothioyl)amino]ethyl-trimethyl-ammonium CAS Name: 2-[[(8-methoxy-2-oxo-1-benzopyran-3-yl)-sulfanylidenemethyl]amino]ethyl-trimethylammonium IUPAC Name: 2-[(8-methoxy-2-oxochromene-3-carbothioyl)amino]ethyl-trimethylazanium Traditional Name: 2-[(2-keto-8-methoxy-chromene-3-carbothioyl)amino]ethyl-trimethyl-ammonium Formula: C16H21N2O3S+ MolecularWeight: 321.41454

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCNC(=S)C1=CC2=C(C(=CC=C2)OC)OC1=O

Isomeric SMILES

C[N+](C)(C)CCNC(=S)C1=CC2=C(C(=CC=C2)OC)OC1=O

InChI

InChI=1S/C16H20N2O3S/c1-18(2,3)9-8-17-15(22)12-10-11-6-5-7-13(20-4)14(11)21-16(12)19/h5-7,10H,8-9H2,1-4H3/p+1