N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzamide

Systemtic Name: N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzamide Openeye Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(Z)-1,2,2-trimethylpropylideneamino]benzamide CAS Name: N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-4-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]benzamide IUPAC Name: N-[(Z)-3,3-dimethylbutan-2-ylideneamino]-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzamide Traditional Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(Z)-1,2,2-trimethylpropylideneamino]benzamide Formula: C25H35N4O2+ MolecularWeight: 423.571

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC)C(C)(C)C

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3OC)/C(C)(C)C

InChI

InChI=1S/C25H34N4O2/c1-19(25(2,3)4)26-27-24(30)21-12-10-20(11-13-21)18-28-14-16-29(17-15-28)22-8-6-7-9-23(22)31-5/h6-13H,14-18H2,1-5H3,(H,27,30)/p+1/b26-19-