(2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydro-1-benzofuran-4-one

Systemtic Name: (2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydro-1-benzofuran-4-one Openeye Name: (2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydrobenzofuran-4-one CAS Name: (2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydrobenzofuran-4-one IUPAC Name: (2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydro-1-benzofuran-4-one Traditional Name: (2R,3R)-3-(3-methoxyphenyl)-6,6-dimethyl-2-nitro-2,3,5,7-tetrahydrobenzofuran-4-one Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(O2)[N+](=O)[O-])C3=CC(=CC=C3)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C([C@H]([C@@H](O2)[N+](=O)[O-])C3=CC(=CC=C3)OC)C(=O)C1)C

InChI

InChI=1S/C17H19NO5/c1-17(2)8-12(19)15-13(9-17)23-16(18(20)21)14(15)10-5-4-6-11(7-10)22-3/h4-7,14,16H,8-9H2,1-3H3/t14-,16-/m1/s1