ethyl 4-[5-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[(E)-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[(E)-3-(3-nitrophenyl)-3-oxo-prop-1-enyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[(E)-3-(3-nitrophenyl)-3-oxoprop-1-enyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-3-keto-3-(3-nitrophenyl)prop-1-enyl]-2-furyl]benzoic acid ethyl ester Formula: C22H17NO6 MolecularWeight: 391.37348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C/C(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17NO6/c1-2-28-22(25)16-8-6-15(7-9-16)21-13-11-19(29-21)10-12-20(24)17-4-3-5-18(14-17)23(26)27/h3-14H,2H2,1H3/b12-10+