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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-2-oxidanylidene-chromen-7-yl] 4-methylbenzoate Openeye Name: [3-(1,3-benzothiazol-2-yl)-2-oxo-chromen-7-yl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [3-(1,3-benzothiazol-2-yl)-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-(1,3-benzothiazol-2-yl)-2-keto-chromen-7-yl] ester Formula: C24H15NO4S MolecularWeight: 413.4452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H15NO4S/c1-14-6-8-15(9-7-14)23(26)28-17-11-10-16-12-18(24(27)29-20(16)13-17)22-25-19-4-2-3-5-21(19)30-22/h2-13H,1H3