(E)-3-[(1S,2R)-1-(furan-2-yl)-2-nitro-2-phenyl-ethyl]-4-oxidanyl-pent-3-en-2-one

Systemtic Name: (E)-3-[(1S,2R)-1-(furan-2-yl)-2-nitro-2-phenyl-ethyl]-4-oxidanyl-pent-3-en-2-one Openeye Name: (E)-3-[(1S,2R)-1-(2-furyl)-2-nitro-2-phenyl-ethyl]-4-hydroxy-pent-3-en-2-one CAS Name: (E)-3-[(1S,2R)-1-(2-furanyl)-2-nitro-2-phenylethyl]-4-hydroxy-3-penten-2-one IUPAC Name: (E)-3-[(1S,2R)-1-(furan-2-yl)-2-nitro-2-phenylethyl]-4-hydroxypent-3-en-2-one Traditional Name: (E)-3-[(1S,2R)-1-(2-furyl)-2-nitro-2-phenyl-ethyl]-4-hydroxy-pent-3-en-2-one Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(C1=CC=CO1)C(C2=CC=CC=C2)[N+](=O)[O-])C(=O)C)O

Isomeric SMILES

C/C(=C(/[C@H](C1=CC=CO1)[C@H](C2=CC=CC=C2)[N+](=O)[O-])\C(=O)C)/O

InChI

InChI=1S/C17H17NO5/c1-11(19)15(12(2)20)16(14-9-6-10-23-14)17(18(21)22)13-7-4-3-5-8-13/h3-10,16-17,19H,1-2H3/b15-11-/t16-,17-/m0/s1