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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(6-ethyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl]-methyl-azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxo-chromen-8-yl)methyl]-methyl-ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxo-1-benzopyran-8-yl)methyl]-methylammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(6-ethyl-7-hydroxy-4-methyl-2-oxochromen-8-yl)methyl]-methylazanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(6-ethyl-7-hydroxy-2-keto-4-methyl-chromen-8-yl)methyl]-methyl-ammonium Formula: C22H23N2O3S+ MolecularWeight: 395.49462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=CC(=O)O2)C)C[NH+](C)CC3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C22H22N2O3S/c1-4-14-10-15-13(2)9-20(25)27-22(15)16(21(14)26)11-24(3)12-19-23-17-7-5-6-8-18(17)28-19/h5-10,26H,4,11-12H2,1-3H3/p+1