ethyl 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: ethyl 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-hydroxy-4-oxo-chromene-2-carboxylate CAS Name: 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-hydroxy-4-oxo-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-hydroxy-4-oxochromene-2-carboxylate Traditional Name: 3-(1,3-benzothiazol-2-yl)-8-(dimethylaminomethyl)-7-hydroxy-4-keto-chromene-2-carboxylic acid ethyl ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C(=C(C=C2)O)CN(C)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H20N2O5S/c1-4-28-22(27)20-17(21-23-14-7-5-6-8-16(14)30-21)18(26)12-9-10-15(25)13(11-24(2)3)19(12)29-20/h5-10,25H,4,11H2,1-3H3