methyl 1-[4-[(2,4-dimethyl-6-oxidanylidene-pyran-3-yl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: methyl 1-[4-[(2,4-dimethyl-6-oxidanylidene-pyran-3-yl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: methyl 1-[4-[(2,4-dimethyl-6-oxo-pyran-3-carbonyl)amino]phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-[[(2,4-dimethyl-6-oxo-3-pyranyl)-oxomethyl]amino]phenyl]sulfonyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(2,4-dimethyl-6-oxopyran-3-carbonyl)amino]phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[4-[(6-keto-2,4-dimethyl-pyran-3-carbonyl)amino]phenyl]sulfonylnipecotic acid methyl ester Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC(=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=O)OC(=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC)C

InChI

InChI=1S/C21H24N2O7S/c1-13-11-18(24)30-14(2)19(13)20(25)22-16-6-8-17(9-7-16)31(27,28)23-10-4-5-15(12-23)21(26)29-3/h6-9,11,15H,4-5,10,12H2,1-3H3,(H,22,25)