2-(2-nitro-4-phenylmethoxy-phenyl)propanedioic acid

Systemtic Name: 2-(2-nitro-4-phenylmethoxy-phenyl)propanedioic acid Openeye Name: 2-(4-benzyloxy-2-nitro-phenyl)propanedioic acid CAS Name: 2-(2-nitro-4-phenylmethoxyphenyl)propanedioic acid IUPAC Name: 2-(2-nitro-4-phenylmethoxyphenyl)propanedioic acid Traditional Name: 2-(4-benzoxy-2-nitro-phenyl)malonic acid Formula: C16H13NO7 MolecularWeight: 331.27692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=C(C=C2)C(C(=O)O)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO7/c18-15(19)14(16(20)21)12-7-6-11(8-13(12)17(22)23)24-9-10-4-2-1-3-5-10/h1-8,14H,9H2,(H,18,19)(H,20,21)