2,2-bis(4-nitrophenyl)hexanedioic acid

Systemtic Name: 2,2-bis(4-nitrophenyl)hexanedioic acid Openeye Name: 2,2-bis(4-nitrophenyl)hexanedioic acid CAS Name: 2,2-bis(4-nitrophenyl)hexanedioic acid IUPAC Name: 2,2-bis(4-nitrophenyl)hexanedioic acid Traditional Name: 2,2-bis(4-nitrophenyl)adipic acid Formula: C18H16N2O8 MolecularWeight: 388.32824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O8/c21-16(22)2-1-11-18(17(23)24,12-3-7-14(8-4-12)19(25)26)13-5-9-15(10-6-13)20(27)28/h3-10H,1-2,11H2,(H,21,22)(H,23,24)