N-cyclopropyl-2-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-2-[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-(4-veratrylpiperazin-1-ium-1-yl)acetyl]amino]benzamide Formula: C25H33N4O4+ MolecularWeight: 453.55392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(=O)NC4CC4)OC

InChI

InChI=1S/C25H32N4O4/c1-32-22-10-7-18(15-23(22)33-2)16-28-11-13-29(14-12-28)17-24(30)27-21-6-4-3-5-20(21)25(31)26-19-8-9-19/h3-7,10,15,19H,8-9,11-14,16-17H2,1-2H3,(H,26,31)(H,27,30)/p+1