N-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitro-heptyl]-1-phenyl-methanimine

Systemtic Name: N-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitro-heptyl]-1-phenyl-methanimine Openeye Name: N-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitro-heptyl]-1-phenyl-methanimine CAS Name: N-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitroheptyl]-1-phenylmethanimine IUPAC Name: N-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitroheptyl]-1-phenylmethanimine Traditional Name: benzal-[1-(4-chlorophenyl)-5,5-dimethoxy-2-nitro-heptyl]amine Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(C(C1=CC=C(C=C1)Cl)N=CC2=CC=CC=C2)[N+](=O)[O-])(OC)OC

Isomeric SMILES

CCC(CCC(C(C1=CC=C(C=C1)Cl)N=CC2=CC=CC=C2)[N+](=O)[O-])(OC)OC

InChI

InChI=1S/C22H27ClN2O4/c1-4-22(28-2,29-3)15-14-20(25(26)27)21(18-10-12-19(23)13-11-18)24-16-17-8-6-5-7-9-17/h5-13,16,20-21H,4,14-15H2,1-3H3