[6-(4-methoxyphenyl)-1,3-dimethyl-8-oxidanylidene-cyclohepta[c]furan-4-yl] 4-nitrobenzoate

Systemtic Name: [6-(4-methoxyphenyl)-1,3-dimethyl-8-oxidanylidene-cyclohepta[c]furan-4-yl] 4-nitrobenzoate Openeye Name: [6-(4-methoxyphenyl)-1,3-dimethyl-8-oxo-cyclohepta[c]furan-4-yl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [6-(4-methoxyphenyl)-1,3-dimethyl-8-oxo-4-cyclohepta[c]furanyl] ester IUPAC Name: [6-(4-methoxyphenyl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [8-keto-6-(4-methoxyphenyl)-1,3-dimethyl-cyclohepta[c]furan-4-yl] ester Formula: C25H19NO7 MolecularWeight: 445.42086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=C(C=C3)OC)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC=C(C=C3)OC)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19NO7/c1-14-23-21(27)12-18(16-6-10-20(31-3)11-7-16)13-22(24(23)15(2)32-14)33-25(28)17-4-8-19(9-5-17)26(29)30/h4-13H,1-3H3