5,7-bis(4-nitrophenyl)adamantan-2-one

Systemtic Name: 5,7-bis(4-nitrophenyl)adamantan-2-one Openeye Name: 5,7-bis(4-nitrophenyl)adamantan-2-one CAS Name: 5,7-bis(4-nitrophenyl)-2-adamantanone IUPAC Name: 5,7-bis(4-nitrophenyl)adamantan-2-one Traditional Name: 5,7-bis(4-nitrophenyl)adamantan-2-one Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC(C2=O)CC1(C3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3(CC(C2=O)CC1(C3)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O5/c25-20-14-9-21(16-1-5-18(6-2-16)23(26)27)10-15(20)12-22(11-14,13-21)17-3-7-19(8-4-17)24(28)29/h1-8,14-15H,9-13H2