methyl (2R)-4-cyclopropyl-2-[(2-nitrophenyl)methyl]-2-oxidanyl-4-oxidanylidene-butanoate

Systemtic Name: methyl (2R)-4-cyclopropyl-2-[(2-nitrophenyl)methyl]-2-oxidanyl-4-oxidanylidene-butanoate Openeye Name: methyl (2R)-4-cyclopropyl-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxo-butanoate CAS Name: (2R)-4-cyclopropyl-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl (2R)-4-cyclopropyl-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxobutanoate Traditional Name: (2R)-4-cyclopropyl-2-hydroxy-4-keto-2-(2-nitrobenzyl)butyric acid methyl ester Formula: C15H17NO6 MolecularWeight: 307.29858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1[N+](=O)[O-])(CC(=O)C2CC2)O

Isomeric SMILES

COC(=O)[C@@](CC1=CC=CC=C1[N+](=O)[O-])(CC(=O)C2CC2)O

InChI

InChI=1S/C15H17NO6/c1-22-14(18)15(19,9-13(17)10-6-7-10)8-11-4-2-3-5-12(11)16(20)21/h2-5,10,19H,6-9H2,1H3/t15-/m1/s1