2,2-bis(4-nitrophenyl)butanoate

Systemtic Name: 2,2-bis(4-nitrophenyl)butanoate Openeye Name: 2,2-bis(4-nitrophenyl)butanoate CAS Name: 2,2-bis(4-nitrophenyl)butanoate IUPAC Name: 2,2-bis(4-nitrophenyl)butanoate Traditional Name: 2,2-bis(4-nitrophenyl)butyrate Formula: C16H13N2O6- MolecularWeight: 329.28422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O6/c1-2-16(15(19)20,11-3-7-13(8-4-11)17(21)22)12-5-9-14(10-6-12)18(23)24/h3-10H,2H2,1H3,(H,19,20)/p-1