(4-methoxycarbonyl-5-methyl-furan-2-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate

Systemtic Name: (4-methoxycarbonyl-5-methyl-furan-2-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Openeye Name: (4-methoxycarbonyl-5-methyl-2-furyl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate CAS Name: 1-[anilino(oxo)methyl]-4-piperidinecarboxylic acid (4-methoxycarbonyl-5-methyl-2-furanyl)methyl ester IUPAC Name: (4-methoxycarbonyl-5-methylfuran-2-yl)methyl 1-(phenylcarbamoyl)piperidine-4-carboxylate Traditional Name: 1-(phenylcarbamoyl)isonipecotic acid (4-carbomethoxy-5-methyl-2-furyl)methyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2CCN(CC2)C(=O)NC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O6/c1-14-18(20(25)27-2)12-17(29-14)13-28-19(24)15-8-10-23(11-9-15)21(26)22-16-6-4-3-5-7-16/h3-7,12,15H,8-11,13H2,1-2H3,(H,22,26)