O1-tert-butyl O2-[3-(3-methoxyphenyl)propyl] (2S)-piperidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[3-(3-methoxyphenyl)propyl] (2S)-piperidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[3-(3-methoxyphenyl)propyl] (2S)-piperidine-1,2-dicarboxylate CAS Name: (2S)-piperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[3-(3-methoxyphenyl)propyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[3-(3-methoxyphenyl)propyl] (2S)-piperidine-1,2-dicarboxylate Traditional Name: (2S)-piperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[3-(3-methoxyphenyl)propyl] ester Formula: C21H31NO5 MolecularWeight: 377.47454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1C(=O)OCCCC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)OCCCC2=CC(=CC=C2)OC

InChI

InChI=1S/C21H31NO5/c1-21(2,3)27-20(24)22-13-6-5-12-18(22)19(23)26-14-8-10-16-9-7-11-17(15-16)25-4/h7,9,11,15,18H,5-6,8,10,12-14H2,1-4H3/t18-/m0/s1