(E)-3-(3-nitro-4-oxidanyl-phenyl)-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-en-1-one

Systemtic Name: (E)-3-(3-nitro-4-oxidanyl-phenyl)-1-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-en-1-one Openeye Name: (E)-3-(4-hydroxy-3-nitro-phenyl)-1-[4-(2-oxo-2-pyrrolidin-1-yl-ethoxy)phenyl]prop-2-en-1-one CAS Name: (E)-3-(4-hydroxy-3-nitrophenyl)-1-[4-[2-oxo-2-(1-pyrrolidinyl)ethoxy]phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-hydroxy-3-nitrophenyl)-1-[4-(2-oxo-2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one Traditional Name: (E)-3-(4-hydroxy-3-nitro-phenyl)-1-[4-(2-keto-2-pyrrolidino-ethoxy)phenyl]prop-2-en-1-one Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC2=CC=C(C=C2)C(=O)C=CC3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)COC2=CC=C(C=C2)C(=O)/C=C/C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O6/c24-19(9-3-15-4-10-20(25)18(13-15)23(27)28)16-5-7-17(8-6-16)29-14-21(26)22-11-1-2-12-22/h3-10,13,25H,1-2,11-12,14H2/b9-3+