N-(3-chloranyl-4-methyl-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(4-p-anisylpiperazine-1,4-diium-1-yl)acetamide Formula: C21H28ClN3O2+2 MolecularWeight: 389.91892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C21H26ClN3O2/c1-16-3-6-18(13-20(16)22)23-21(26)15-25-11-9-24(10-12-25)14-17-4-7-19(27-2)8-5-17/h3-8,13H,9-12,14-15H2,1-2H3,(H,23,26)/p+2