1-(4-methyl-3-nitro-phenyl)-3-phenyl-adamantane

Systemtic Name: 1-(4-methyl-3-nitro-phenyl)-3-phenyl-adamantane Openeye Name: 1-(4-methyl-3-nitro-phenyl)-3-phenyl-adamantane CAS Name: 1-(4-methyl-3-nitrophenyl)-3-phenyladamantane IUPAC Name: 1-(4-methyl-3-nitrophenyl)-3-phenyladamantane Traditional Name: 1-(4-methyl-3-nitro-phenyl)-3-phenyl-adamantane Formula: C23H25NO2 MolecularWeight: 347.4501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H25NO2/c1-16-7-8-20(10-21(16)24(25)26)23-13-17-9-18(14-23)12-22(11-17,15-23)19-5-3-2-4-6-19/h2-8,10,17-18H,9,11-15H2,1H3