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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-2-propan-2-yl-chromen-7-yl] propanoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-isopropyl-4-oxo-chromen-7-yl] propanoate CAS Name: propanoic acid [3-(1,3-benzothiazol-2-yl)-4-oxo-2-propan-2-yl-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-4-oxo-2-propan-2-ylchromen-7-yl] propanoate Traditional Name: propionic acid [3-(1,3-benzothiazol-2-yl)-2-isopropyl-4-keto-chromen-7-yl] ester Formula: C22H19NO4S MolecularWeight: 393.45556

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3

InChI

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