[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 1-phenylaziridine-2-carboxylate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 1-phenylaziridine-2-carboxylate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 1-phenylaziridine-2-carboxylate CAS Name: 1-phenyl-2-aziridinecarboxylic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 1-phenylaziridine-2-carboxylate Traditional Name: 1-phenylethylenimine-2-carboxylic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C19H27NO2 MolecularWeight: 301.42318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2CN2C3=CC=CC=C3)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2CN2C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C19H27NO2/c1-13(2)16-10-9-14(3)11-18(16)22-19(21)17-12-20(17)15-7-5-4-6-8-15/h4-8,13-14,16-18H,9-12H2,1-3H3/t14-,16+,17?,18-,20?/m1/s1