ethyl (2S,3R)-3-[(2R,6S)-6-methyloxan-2-yl]oxy-2-nitro-3-phenyl-propanoate

Systemtic Name: ethyl (2S,3R)-3-[(2R,6S)-6-methyloxan-2-yl]oxy-2-nitro-3-phenyl-propanoate Openeye Name: ethyl (2S,3R)-3-[(2R,6S)-6-methyltetrahydropyran-2-yl]oxy-2-nitro-3-phenyl-propanoate CAS Name: (2S,3R)-3-[[(2R,6S)-6-methyl-2-oxanyl]oxy]-2-nitro-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-[(2R,6S)-6-methyloxan-2-yl]oxy-2-nitro-3-phenylpropanoate Traditional Name: (2S,3R)-3-[(2R,6S)-6-methyltetrahydropyran-2-yl]oxy-2-nitro-3-phenyl-propionic acid ethyl ester Formula: C17H23NO6 MolecularWeight: 337.36762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)OC2CCCC(O2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C1=CC=CC=C1)O[C@@H]2CCC[C@@H](O2)C)[N+](=O)[O-]

InChI

InChI=1S/C17H23NO6/c1-3-22-17(19)15(18(20)21)16(13-9-5-4-6-10-13)24-14-11-7-8-12(2)23-14/h4-6,9-10,12,14-16H,3,7-8,11H2,1-2H3/t12-,14+,15-,16+/m0/s1