[(1R,2S)-2-(2-azanyl-2-oxidanylidene-ethyl)-2-(3-phenylmethoxypropyl)cyclohexyl] ethanoate

Systemtic Name: [(1R,2S)-2-(2-azanyl-2-oxidanylidene-ethyl)-2-(3-phenylmethoxypropyl)cyclohexyl] ethanoate Openeye Name: [(1R,2S)-2-(2-amino-2-oxo-ethyl)-2-(3-benzyloxypropyl)cyclohexyl] acetate CAS Name: acetic acid [(1R,2S)-2-(2-amino-2-oxoethyl)-2-(3-phenylmethoxypropyl)cyclohexyl] ester IUPAC Name: [(1R,2S)-2-(2-amino-2-oxoethyl)-2-(3-phenylmethoxypropyl)cyclohexyl] acetate Traditional Name: acetic acid [(1R,2S)-2-(2-amino-2-keto-ethyl)-2-(3-benzoxypropyl)cyclohexyl] ester Formula: C20H29NO4 MolecularWeight: 347.44856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCCC1(CCCOCC2=CC=CC=C2)CC(=O)N

Isomeric SMILES

CC(=O)O[C@@H]1CCCC[C@]1(CCCOCC2=CC=CC=C2)CC(=O)N

InChI

InChI=1S/C20H29NO4/c1-16(22)25-18-10-5-6-11-20(18,14-19(21)23)12-7-13-24-15-17-8-3-2-4-9-17/h2-4,8-9,18H,5-7,10-15H2,1H3,(H2,21,23)/t18-,20+/m1/s1