N-[(Z)-(3-bromophenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-[(Z)-(3-bromophenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-[(Z)-(3-bromophenyl)methyleneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-[(Z)-(3-bromophenyl)methylideneamino]-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-[(Z)-(3-bromophenyl)methylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-[(Z)-(3-bromobenzylidene)amino]-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C20H24BrN4O+ MolecularWeight: 416.33476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN4O/c21-18-6-4-5-17(15-18)16-22-23-20(26)9-10-24-11-13-25(14-12-24)19-7-2-1-3-8-19/h1-8,15-16H,9-14H2,(H,23,26)/p+1/b22-16-