[(1R,3S)-3-(4-methoxyphenyl)-1-(4-nitrophenyl)-3-oxidanyl-propyl] ethanoate

Systemtic Name: [(1R,3S)-3-(4-methoxyphenyl)-1-(4-nitrophenyl)-3-oxidanyl-propyl] ethanoate Openeye Name: [(1R,3S)-3-hydroxy-3-(4-methoxyphenyl)-1-(4-nitrophenyl)propyl] acetate CAS Name: acetic acid [(1R,3S)-3-hydroxy-3-(4-methoxyphenyl)-1-(4-nitrophenyl)propyl] ester IUPAC Name: [(1R,3S)-3-hydroxy-3-(4-methoxyphenyl)-1-(4-nitrophenyl)propyl] acetate Traditional Name: acetic acid [(1R,3S)-3-hydroxy-3-(4-methoxyphenyl)-1-(4-nitrophenyl)propyl] ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC(C1=CC=C(C=C1)OC)O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)O[C@H](C[C@@H](C1=CC=C(C=C1)OC)O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19NO6/c1-12(20)25-18(14-3-7-15(8-4-14)19(22)23)11-17(21)13-5-9-16(24-2)10-6-13/h3-10,17-18,21H,11H2,1-2H3/t17-,18+/m0/s1