(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate CAS Name: 1-(2,2-dimethyl-1-oxopropyl)-4-piperidinecarboxylic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 1-(2,2-dimethylpropanoyl)piperidine-4-carboxylate Traditional Name: 1-pivaloylisonipecotic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H26ClNO5 MolecularWeight: 419.89854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCN(CC3)C(=O)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCN(CC3)C(=O)C(C)(C)C)Cl

InChI

InChI=1S/C22H26ClNO5/c1-13-9-18-16(11-17(13)23)15(10-19(25)29-18)12-28-20(26)14-5-7-24(8-6-14)21(27)22(2,3)4/h9-11,14H,5-8,12H2,1-4H3