2,5-dimethoxy-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide

Systemtic Name: 2,5-dimethoxy-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Openeye Name: 2,5-dimethoxy-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide CAS Name: 2,5-dimethoxy-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzamide IUPAC Name: 2,5-dimethoxy-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Traditional Name: 2,5-dimethoxy-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(=O)NCC[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H27N3O3/c1-26-18-8-9-20(27-2)19(16-18)21(25)22-10-11-23-12-14-24(15-13-23)17-6-4-3-5-7-17/h3-9,16H,10-15H2,1-2H3,(H,22,25)/p+1