(2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitro-butoxy]-6-methyl-oxane

Systemtic Name: (2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitro-butoxy]-6-methyl-oxane Openeye Name: (2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitro-butoxy]-6-methyl-tetrahydropyran CAS Name: (2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitrobutoxy]-6-methyloxane IUPAC Name: (2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitrobutoxy]-6-methyloxane Traditional Name: (2R,6S)-2-[(1R,2S)-1-(4-methoxyphenyl)-2-nitro-butoxy]-6-methyl-tetrahydropyran Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO5/c1-4-15(18(19)20)17(13-8-10-14(21-3)11-9-13)23-16-7-5-6-12(2)22-16/h8-12,15-17H,4-7H2,1-3H3/t12-,15-,16+,17+/m0/s1