O1-tert-butyl O3-methyl (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-methyl (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-methyl (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylate CAS Name: (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester IUPAC Name: 1-O-tert-butyl 3-O-methyl (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylate Traditional Name: (3R,6S)-6-(4,4-diphenylbutyl)piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester Formula: C28H37NO4 MolecularWeight: 451.59768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CCC1CCCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H](CC[C@@H]1CCCC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C28H37NO4/c1-28(2,3)33-27(31)29-20-23(26(30)32-4)18-19-24(29)16-11-17-25(21-12-7-5-8-13-21)22-14-9-6-10-15-22/h5-10,12-15,23-25H,11,16-20H2,1-4H3/t23-,24+/m1/s1