ethyl 4-(3-methoxyphenyl)-3-nitro-benzoate

Systemtic Name: ethyl 4-(3-methoxyphenyl)-3-nitro-benzoate Openeye Name: ethyl 4-(3-methoxyphenyl)-3-nitro-benzoate CAS Name: 4-(3-methoxyphenyl)-3-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 4-(3-methoxyphenyl)-3-nitrobenzoate Traditional Name: 4-(3-methoxyphenyl)-3-nitro-benzoic acid ethyl ester Formula: C16H15NO5 MolecularWeight: 301.294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO5/c1-3-22-16(18)12-7-8-14(15(10-12)17(19)20)11-5-4-6-13(9-11)21-2/h4-10H,3H2,1-2H3