2-[(Z)-(4-tert-butylphenyl)methylideneamino]oxy-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-[(Z)-(4-tert-butylphenyl)methylideneamino]oxy-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[(Z)-(4-tert-butylphenyl)methyleneamino]oxy-ethanone CAS Name: 2-[(Z)-(4-tert-butylphenyl)methylideneamino]oxy-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[(Z)-(4-tert-butylphenyl)methylideneamino]oxyethanone Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-[(Z)-(4-tert-butylbenzylidene)amino]oxy-ethanone Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=NOCC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=N\OCC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2/c1-24(2,3)22-11-9-20(10-12-22)17-25-29-19-23(28)27-15-13-26(14-16-27)18-21-7-5-4-6-8-21/h4-12,17H,13-16,18-19H2,1-3H3/p+1/b25-17-