4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-(propan-2-ylideneamino)benzamide

Systemtic Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-(propan-2-ylideneamino)benzamide Openeye Name: N-(isopropylideneamino)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzamide CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-N-(propan-2-ylideneamino)benzamide IUPAC Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-(propan-2-ylideneamino)benzamide Traditional Name: N-(isopropylideneamino)-4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzamide Formula: C22H29N4O2+ MolecularWeight: 381.49126

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N4O2/c1-17(2)23-24-22(27)19-10-8-18(9-11-19)16-25-12-14-26(15-13-25)20-6-4-5-7-21(20)28-3/h4-11H,12-16H2,1-3H3,(H,24,27)/p+1