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

Systemtic Name: methyl (2R)-2-[(2-nitrophenyl)methyl]-2-oxidanyl-4-oxidanylidene-nonanoate Openeye Name: methyl (2R)-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxo-nonanoate CAS Name: (2R)-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxononanoic acid methyl ester IUPAC Name: methyl (2R)-2-hydroxy-2-[(2-nitrophenyl)methyl]-4-oxononanoate Traditional Name: (2R)-2-hydroxy-4-keto-2-(2-nitrobenzyl)pelargonic acid methyl ester Formula: C17H23NO6 MolecularWeight: 337.36762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)CC(CC1=CC=CC=C1[N+](=O)[O-])(C(=O)OC)O

Isomeric SMILES

CCCCCC(=O)C[C@](CC1=CC=CC=C1[N+](=O)[O-])(C(=O)OC)O

InChI

InChI=1S/C17H23NO6/c1-3-4-5-9-14(19)12-17(21,16(20)24-2)11-13-8-6-7-10-15(13)18(22)23/h6-8,10,21H,3-5,9,11-12H2,1-2H3/t17-/m1/s1