[3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxidanylidene-2-propan-2-yl-chromen-7-yl] propanoate

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxidanylidene-2-propan-2-yl-chromen-7-yl] propanoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-isopropyl-8-methyl-4-oxo-chromen-7-yl] propanoate CAS Name: propanoic acid [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-yl-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] propanoate Traditional Name: propionic acid [3-(1,3-benzothiazol-2-yl)-2-isopropyl-4-keto-8-methyl-chromen-7-yl] ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(C2=C(C=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CCC(=O)OC1=C(C2=C(C=C1)C(=O)C(=C(O2)C(C)C)C3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C23H21NO4S/c1-5-18(25)27-16-11-10-14-20(26)19(21(12(2)3)28-22(14)13(16)4)23-24-15-8-6-7-9-17(15)29-23/h6-12H,5H2,1-4H3