[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(phenylmethyl)iminopropanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 2-(phenylmethyl)iminopropanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 2-benzyliminopropanoate CAS Name: 2-(phenylmethyl)iminopropanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2-benzyliminopropanoate Traditional Name: 2-benzyliminopropionic acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C20H29NO2 MolecularWeight: 315.44976

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(=NCC2=CC=CC=C2)C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(=NCC2=CC=CC=C2)C)C(C)C

InChI

InChI=1S/C20H29NO2/c1-14(2)18-11-10-15(3)12-19(18)23-20(22)16(4)21-13-17-8-6-5-7-9-17/h5-9,14-15,18-19H,10-13H2,1-4H3/t15-,18+,19-/m1/s1