[3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxidanylidene-chromen-7-yl] 2-methylpropanoate

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxidanylidene-chromen-7-yl] 2-methylpropanoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxo-chromen-7-yl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxochromen-7-yl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-keto-chromen-7-yl] ester Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C(C)C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H19NO4S/c1-4-16-19(21-23-15-7-5-6-8-18(15)28-21)20(24)14-10-9-13(11-17(14)27-16)26-22(25)12(2)3/h5-12H,4H2,1-3H3