4-bromanyl-N-[(Z)-[3-(4-methylpiperazin-4-ium-1-yl)-2-nitro-phenyl]methylideneamino]aniline

Systemtic Name: 4-bromanyl-N-[(Z)-[3-(4-methylpiperazin-4-ium-1-yl)-2-nitro-phenyl]methylideneamino]aniline Openeye Name: 4-bromo-N-[(Z)-[3-(4-methylpiperazin-4-ium-1-yl)-2-nitro-phenyl]methyleneamino]aniline CAS Name: 4-bromo-N-[(Z)-[3-(4-methyl-1-piperazin-4-iumyl)-2-nitrophenyl]methylideneamino]aniline IUPAC Name: 4-bromo-N-[(Z)-[3-(4-methylpiperazin-4-ium-1-yl)-2-nitrophenyl]methylideneamino]aniline Traditional Name: (4-bromophenyl)-[(Z)-[3-(4-methylpiperazin-4-ium-1-yl)-2-nitro-benzylidene]amino]amine Formula: C18H21BrN5O2+ MolecularWeight: 419.29564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC(=C2[N+](=O)[O-])C=NNC3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC(=C2[N+](=O)[O-])/C=N\NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H20BrN5O2/c1-22-9-11-23(12-10-22)17-4-2-3-14(18(17)24(25)26)13-20-21-16-7-5-15(19)6-8-16/h2-8,13,21H,9-12H2,1H3/p+1/b20-13-