methyl 4-(4-nitro-3-phenylmethoxy-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-nitro-3-phenylmethoxy-phenyl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(3-benzyloxy-4-nitro-phenyl)-4-oxo-butanoate CAS Name: 4-(4-nitro-3-phenylmethoxyphenyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-nitro-3-phenylmethoxyphenyl)-4-oxobutanoate Traditional Name: 4-(3-benzoxy-4-nitro-phenyl)-4-keto-butyric acid methyl ester Formula: C18H17NO6 MolecularWeight: 343.33068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])OCC2=CC=CC=C2

InChI

InChI=1S/C18H17NO6/c1-24-18(21)10-9-16(20)14-7-8-15(19(22)23)17(11-14)25-12-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3