bis(2-methoxyethyl) (2R,4R)-2,4-diethanoyl-3-(3-nitrophenyl)pentanedioate

Systemtic Name: bis(2-methoxyethyl) (2R,4R)-2,4-diethanoyl-3-(3-nitrophenyl)pentanedioate Openeye Name: bis(2-methoxyethyl) (2R,4R)-2,4-diacetyl-3-(3-nitrophenyl)pentanedioate CAS Name: (2R,4R)-2,4-diacetyl-3-(3-nitrophenyl)pentanedioic acid bis(2-methoxyethyl) ester IUPAC Name: bis(2-methoxyethyl) (2R,4R)-2,4-diacetyl-3-(3-nitrophenyl)pentanedioate Traditional Name: (2R,4R)-2,4-diacetyl-3-(3-nitrophenyl)glutaric acid bis(2-methoxyethyl) ester Formula: C21H27NO10 MolecularWeight: 453.43978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO10/c1-13(23)17(20(25)31-10-8-29-3)19(15-6-5-7-16(12-15)22(27)28)18(14(2)24)21(26)32-11-9-30-4/h5-7,12,17-19H,8-11H2,1-4H3/t17-,18-/m0/s1