N-[5-(1-adamantyl)-2-methyl-phenyl]-1-(4-octoxyphenyl)methanimine

Systemtic Name: N-[5-(1-adamantyl)-2-methyl-phenyl]-1-(4-octoxyphenyl)methanimine Openeye Name: N-[5-(1-adamantyl)-2-methyl-phenyl]-1-(4-octoxyphenyl)methanimine CAS Name: N-[5-(1-adamantyl)-2-methylphenyl]-1-(4-octoxyphenyl)methanimine IUPAC Name: N-[5-(1-adamantyl)-2-methylphenyl]-1-(4-octoxyphenyl)methanimine Traditional Name: [5-(1-adamantyl)-2-methyl-phenyl]-(4-octoxybenzylidene)amine Formula: C32H43NO MolecularWeight: 457.68992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=NC2=C(C=CC(=C2)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C=NC2=C(C=CC(=C2)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C32H43NO/c1-3-4-5-6-7-8-15-34-30-13-10-25(11-14-30)23-33-31-19-29(12-9-24(31)2)32-20-26-16-27(21-32)18-28(17-26)22-32/h9-14,19,23,26-28H,3-8,15-18,20-22H2,1-2H3