(4-methyl-2-oxidanylidene-chromen-7-yl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-cyanophenyl)sulfonyl-4-piperidinecarboxylic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 1-(4-cyanophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-cyanophenyl)sulfonylisonipecotic 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)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

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