[2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxidanylidene-ethyl] 2-phenoxyethanoate

Systemtic Name: [2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxidanylidene-ethyl] 2-phenoxyethanoate Openeye Name: [2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxo-ethyl] 2-phenoxyacetate CAS Name: 2-phenoxyacetic acid [2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl] 2-phenoxyacetate Traditional Name: 2-phenoxyacetic acid [2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-keto-ethyl] ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)COC(=O)COC2=CC=CC=C2

Isomeric SMILES

C[C@@H]1CCC[C@@H]([C@@H]1C)NC(=O)COC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C18H25NO4/c1-13-7-6-10-16(14(13)2)19-17(20)11-23-18(21)12-22-15-8-4-3-5-9-15/h3-5,8-9,13-14,16H,6-7,10-12H2,1-2H3,(H,19,20)/t13-,14-,16+/m1/s1