N-[(Z)-(4-bromophenyl)methylideneamino]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide

Systemtic Name: N-[(Z)-(4-bromophenyl)methylideneamino]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-[(Z)-(4-bromophenyl)methyleneamino]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-[(Z)-(4-bromophenyl)methylideneamino]-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]benzamide IUPAC Name: N-[(Z)-(4-bromophenyl)methylideneamino]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-[(Z)-(4-bromobenzylidene)amino]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C25H26BrN4O+ MolecularWeight: 478.40414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NN=CC3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)N/N=C\C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C25H25BrN4O/c26-23-12-8-20(9-13-23)18-27-28-25(31)22-10-6-21(7-11-22)19-29-14-16-30(17-15-29)24-4-2-1-3-5-24/h1-13,18H,14-17,19H2,(H,28,31)/p+1/b27-18-