(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C19H22NO3S+ MolecularWeight: 344.44788

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=C(C=CS3)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=C(C=CS3)C)O

InChI

InChI=1S/C19H21NO3S/c1-4-13-7-15-14(8-19(22)23-17(15)9-16(13)21)10-20(3)11-18-12(2)5-6-24-18/h5-9,21H,4,10-11H2,1-3H3/p+1