2-[4-(4-methoxyphenyl)-2-nitro-phenyl]propanedioic acid

Systemtic Name: 2-[4-(4-methoxyphenyl)-2-nitro-phenyl]propanedioic acid Openeye Name: 2-[4-(4-methoxyphenyl)-2-nitro-phenyl]propanedioic acid CAS Name: 2-[4-(4-methoxyphenyl)-2-nitrophenyl]propanedioic acid IUPAC Name: 2-[4-(4-methoxyphenyl)-2-nitrophenyl]propanedioic acid Traditional Name: 2-[4-(4-methoxyphenyl)-2-nitro-phenyl]malonic acid Formula: C16H13NO7 MolecularWeight: 331.27692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C(C=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=C(C=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7/c1-24-11-5-2-9(3-6-11)10-4-7-12(13(8-10)17(22)23)14(15(18)19)16(20)21/h2-8,14H,1H3,(H,18,19)(H,20,21)