(2R)-2-[(R)-(4-nitrophenyl)-oxidanyl-methyl]pent-4-enal

Systemtic Name: (2R)-2-[(R)-(4-nitrophenyl)-oxidanyl-methyl]pent-4-enal Openeye Name: (2R)-2-[(R)-hydroxy-(4-nitrophenyl)methyl]pent-4-enal CAS Name: (2R)-2-[(R)-hydroxy-(4-nitrophenyl)methyl]-4-pentenal IUPAC Name: (2R)-2-[(R)-hydroxy-(4-nitrophenyl)methyl]pent-4-enal Traditional Name: (2R)-2-[(R)-hydroxy-(4-nitrophenyl)methyl]pent-4-enal Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-2-3-10(8-14)12(15)9-4-6-11(7-5-9)13(16)17/h2,4-8,10,12,15H,1,3H2/t10-,12-/m0/s1