O1-tert-butyl O4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-[2-(4-butylanilino)-2-oxo-ethyl] piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 4-O-[2-(4-butylanilino)-2-oxoethyl] piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-[2-(4-butylanilino)-2-keto-ethyl] ester Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H34N2O5/c1-5-6-7-17-8-10-19(11-9-17)24-20(26)16-29-21(27)18-12-14-25(15-13-18)22(28)30-23(2,3)4/h8-11,18H,5-7,12-16H2,1-4H3,(H,24,26)