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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-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-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H23ClN2O5 MolecularWeight: 454.90282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3CCN(CC3)C(=O)NC4=CC=CC=C4)Cl

InChI

InChI=1S/C24H23ClN2O5/c1-15-11-21-19(13-20(15)25)17(12-22(28)32-21)14-31-23(29)16-7-9-27(10-8-16)24(30)26-18-5-3-2-4-6-18/h2-6,11-13,16H,7-10,14H2,1H3,(H,26,30)