(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl-methyl-(2-thienylmethyl)ammonium CAS Name: (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (7-ethyl-2-keto-chromen-4-yl)methyl-methyl-(2-thenyl)ammonium Formula: C18H20NO2S+ MolecularWeight: 314.4219

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CS3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC=CS3

InChI

InChI=1S/C18H19NO2S/c1-3-13-6-7-16-14(10-18(20)21-17(16)9-13)11-19(2)12-15-5-4-8-22-15/h4-10H,3,11-12H2,1-2H3/p+1