3-(2-nitro-4-phenylmethoxy-phenyl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(2-nitro-4-phenylmethoxy-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(4-benzyloxy-2-nitro-phenyl)-2-oxo-propanoic acid CAS Name: 3-(2-nitro-4-phenylmethoxyphenyl)-2-oxopropanoic acid IUPAC Name: 3-(2-nitro-4-phenylmethoxyphenyl)-2-oxopropanoic acid Traditional Name: 3-(4-benzoxy-2-nitro-phenyl)-2-keto-propionic acid Formula: C16H13NO6 MolecularWeight: 315.27752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO6/c18-15(16(19)20)8-12-6-7-13(9-14(12)17(21)22)23-10-11-4-2-1-3-5-11/h1-7,9H,8,10H2,(H,19,20)