O1-tert-butyl O4-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-(2-methoxy-5-methyl-anilino)-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(2-methoxy-5-methylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-(2-methoxy-5-methylanilino)-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-keto-2-(2-methoxy-5-methyl-anilino)ethyl] ester Formula: C21H30N2O6 MolecularWeight: 406.4727

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H30N2O6/c1-14-6-7-17(27-5)16(12-14)22-18(24)13-28-19(25)15-8-10-23(11-9-15)20(26)29-21(2,3)4/h6-7,12,15H,8-11,13H2,1-5H3,(H,22,24)