(3S,4R)-4-butyl-3-[(2-nitrophenyl)methyl]-3-oxidanyl-oxolan-2-one

Systemtic Name: (3S,4R)-4-butyl-3-[(2-nitrophenyl)methyl]-3-oxidanyl-oxolan-2-one Openeye Name: (3S,4R)-4-butyl-3-hydroxy-3-[(2-nitrophenyl)methyl]tetrahydrofuran-2-one CAS Name: (3S,4R)-4-butyl-3-hydroxy-3-[(2-nitrophenyl)methyl]-2-oxolanone IUPAC Name: (3S,4R)-4-butyl-3-hydroxy-3-[(2-nitrophenyl)methyl]oxolan-2-one Traditional Name: (3S,4R)-4-butyl-3-hydroxy-3-(2-nitrobenzyl)tetrahydrofuran-2-one Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COC(=O)C1(CC2=CC=CC=C2[N+](=O)[O-])O

Isomeric SMILES

CCCC[C@@H]1COC(=O)[C@@]1(CC2=CC=CC=C2[N+](=O)[O-])O

InChI

InChI=1S/C15H19NO5/c1-2-3-7-12-10-21-14(17)15(12,18)9-11-6-4-5-8-13(11)16(19)20/h4-6,8,12,18H,2-3,7,9-10H2,1H3/t12-,15+/m1/s1