(E)-5-(2-nitrophenyl)-3-oxidanylidene-2-(oxolan-2-ylmethyl)pent-4-enoic acid

Systemtic Name: (E)-5-(2-nitrophenyl)-3-oxidanylidene-2-(oxolan-2-ylmethyl)pent-4-enoic acid Openeye Name: (E)-5-(2-nitrophenyl)-3-oxo-2-(tetrahydrofuran-2-ylmethyl)pent-4-enoic acid CAS Name: (E)-5-(2-nitrophenyl)-3-oxo-2-(2-oxolanylmethyl)-4-pentenoic acid IUPAC Name: (E)-5-(2-nitrophenyl)-3-oxo-2-(oxolan-2-ylmethyl)pent-4-enoic acid Traditional Name: (E)-3-keto-5-(2-nitrophenyl)-2-(tetrahydrofurfuryl)pent-4-enoic acid Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CC(C(=O)C=CC2=CC=CC=C2[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC(OC1)CC(C(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H17NO6/c18-15(13(16(19)20)10-12-5-3-9-23-12)8-7-11-4-1-2-6-14(11)17(21)22/h1-2,4,6-8,12-13H,3,5,9-10H2,(H,19,20)/b8-7+