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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxidanylidene-chromen-7-yl] propanoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-oxo-chromen-7-yl] propanoate CAS Name: propanoic 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] propanoate Traditional Name: propionic acid [3-(1,3-benzothiazol-2-yl)-2-ethyl-4-keto-chromen-7-yl] ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17NO4S/c1-3-15-19(21-22-14-7-5-6-8-17(14)27-21)20(24)13-10-9-12(11-16(13)26-15)25-18(23)4-2/h5-11H,3-4H2,1-2H3