1-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-[4-methoxy-3-[(4-nitrophenyl)methoxy]phenyl]-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-[4-methoxy-3-(4-nitrobenzyl)oxy-benzylidene]-(4-methylpiperazin-4-ium-1-yl)amine Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C=C2)OC)OCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C=C2)OC)OCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4/c1-22-9-11-23(12-10-22)21-14-17-5-8-19(27-2)20(13-17)28-15-16-3-6-18(7-4-16)24(25)26/h3-8,13-14H,9-12,15H2,1-2H3/p+1/b21-14-