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

Systemtic Name: [3-(1,3-benzothiazol-2-yl)-4-oxidanylidene-chromen-7-yl] cyclohexanecarboxylate Openeye Name: [3-(1,3-benzothiazol-2-yl)-4-oxo-chromen-7-yl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [3-(1,3-benzothiazol-2-yl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1,3-benzothiazol-2-yl)-4-oxochromen-7-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [3-(1,3-benzothiazol-2-yl)-4-keto-chromen-7-yl] ester Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CO3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H19NO4S/c25-21-16-11-10-15(28-23(26)14-6-2-1-3-7-14)12-19(16)27-13-17(21)22-24-18-8-4-5-9-20(18)29-22/h4-5,8-14H,1-3,6-7H2