(4-methyl-2-oxidanylidene-chromen-7-yl) 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-4-carboxylate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 1-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]piperidine-4-carboxylate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxylate CAS Name: 1-(1,1-dioxo-1,2-benzothiazol-3-yl)-4-piperidinecarboxylic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 1-(1,1-dioxo-1,2-benzothiazol-3-yl)piperidine-4-carboxylate Traditional Name: 1-(1,1-diketo-1,2-benzothiazol-3-yl)isonipecotic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C23H20N2O6S MolecularWeight: 452.4797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCN(CC3)C4=NS(=O)(=O)C5=CC=CC=C54

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCN(CC3)C4=NS(=O)(=O)C5=CC=CC=C54

InChI

InChI=1S/C23H20N2O6S/c1-14-12-21(26)31-19-13-16(6-7-17(14)19)30-23(27)15-8-10-25(11-9-15)22-18-4-2-3-5-20(18)32(28,29)24-22/h2-7,12-13,15H,8-11H2,1H3