O3-tert-butyl O1-ethyl 3-[(4-methylphenyl)methyl]piperidine-1,3-dicarboxylate

Systemtic Name: O3-tert-butyl O1-ethyl 3-[(4-methylphenyl)methyl]piperidine-1,3-dicarboxylate Openeye Name: O3-tert-butyl O1-ethyl 3-(p-tolylmethyl)piperidine-1,3-dicarboxylate CAS Name: 3-[(4-methylphenyl)methyl]piperidine-1,3-dicarboxylic acid O3-tert-butyl ester O1-ethyl ester IUPAC Name: 3-O-tert-butyl 1-O-ethyl 3-[(4-methylphenyl)methyl]piperidine-1,3-dicarboxylate Traditional Name: 3-(4-methylbenzyl)piperidine-1,3-dicarboxylic acid O3-tert-butyl ester O1-ethyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)(CC2=CC=C(C=C2)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)(CC2=CC=C(C=C2)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H31NO4/c1-6-25-19(24)22-13-7-12-21(15-22,18(23)26-20(3,4)5)14-17-10-8-16(2)9-11-17/h8-11H,6-7,12-15H2,1-5H3