O1-tert-butyl O2-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-ethanoylaziridine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-ethanoylaziridine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[(1R,2S,5R)-5-methyl-2-(1-methyl-1-phenyl-ethyl)cyclohexyl] 2-acetylaziridine-1,2-dicarboxylate CAS Name: 2-acetylaziridine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[(1R,2S,5R)-5-methyl-2-(2-phenylpropan-2-yl)cyclohexyl] 2-acetylaziridine-1,2-dicarboxylate Traditional Name: 2-acetylethylenimine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[(1R,2S,5R)-2-cumyl-5-methyl-cyclohexyl] ester Formula: C26H37NO5 MolecularWeight: 443.57568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2(CN2C(=O)OC(C)(C)C)C(=O)C)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2(CN2C(=O)OC(C)(C)C)C(=O)C)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C26H37NO5/c1-17-13-14-20(25(6,7)19-11-9-8-10-12-19)21(15-17)31-22(29)26(18(2)28)16-27(26)23(30)32-24(3,4)5/h8-12,17,20-21H,13-16H2,1-7H3/t17-,20-,21-,26?,27?/m1/s1