3,3-bis(4-nitrophenyl)propanoic acid

Systemtic Name: 3,3-bis(4-nitrophenyl)propanoic acid Openeye Name: 3,3-bis(4-nitrophenyl)propanoic acid CAS Name: 3,3-bis(4-nitrophenyl)propanoic acid IUPAC Name: 3,3-bis(4-nitrophenyl)propanoic acid Traditional Name: 3,3-bis(4-nitrophenyl)propionic acid Formula: C15H12N2O6 MolecularWeight: 316.26558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O6/c18-15(19)9-14(10-1-5-12(6-2-10)16(20)21)11-3-7-13(8-4-11)17(22)23/h1-8,14H,9H2,(H,18,19)