N-[5-(1-adamantyl)-2,3-dimethyl-phenyl]-1-(4-nitrophenyl)methanimine

Systemtic Name: N-[5-(1-adamantyl)-2,3-dimethyl-phenyl]-1-(4-nitrophenyl)methanimine Openeye Name: N-[5-(1-adamantyl)-2,3-dimethyl-phenyl]-1-(4-nitrophenyl)methanimine CAS Name: N-[5-(1-adamantyl)-2,3-dimethylphenyl]-1-(4-nitrophenyl)methanimine IUPAC Name: N-[5-(1-adamantyl)-2,3-dimethylphenyl]-1-(4-nitrophenyl)methanimine Traditional Name: [5-(1-adamantyl)-2,3-dimethyl-phenyl]-(4-nitrobenzylidene)amine Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C23CC4CC(C2)CC(C4)C3)N=CC5=CC=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC(=C1)C23CC4CC(C2)CC(C4)C3)N=CC5=CC=C(C=C5)[N+](=O)[O-])C

InChI

InChI=1S/C25H28N2O2/c1-16-7-22(25-12-19-8-20(13-25)10-21(9-19)14-25)11-24(17(16)2)26-15-18-3-5-23(6-4-18)27(28)29/h3-7,11,15,19-21H,8-10,12-14H2,1-2H3