[3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-oxidanyl-4-oxidanylidene-chromen-8-yl]methyl-dimethyl-azanium Openeye Name: [3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-hydroxy-4-oxo-chromen-8-yl]methyl-dimethyl-ammonium CAS Name: [3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-hydroxy-4-oxo-1-benzopyran-8-yl]methyl-dimethylammonium IUPAC Name: [3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-hydroxy-4-oxochromen-8-yl]methyl-dimethylazanium Traditional Name: [3-(1,3-benzothiazol-2-yl)-2,6-diethyl-7-hydroxy-4-keto-chromen-8-yl]methyl-dimethyl-ammonium Formula: C23H25N2O3S+ MolecularWeight: 409.5212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)CC)C3=NC4=CC=CC=C4S3)C[NH+](C)C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C(=C(O2)CC)C3=NC4=CC=CC=C4S3)C[NH+](C)C)O

InChI

InChI=1S/C23H24N2O3S/c1-5-13-11-14-21(27)19(23-24-16-9-7-8-10-18(16)29-23)17(6-2)28-22(14)15(20(13)26)12-25(3)4/h7-11,26H,5-6,12H2,1-4H3/p+1