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

Systemtic Name: N-cyclopropyl-3-[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-3-[[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-3-[[1-oxo-2-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-cyclopropyl-3-[[2-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-3-[[2-[4-(2,3,4-trimethoxybenzyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H35N4O5+ MolecularWeight: 483.5799

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)NC4CC4)OC)OC

InChI

InChI=1S/C26H34N4O5/c1-33-22-10-7-19(24(34-2)25(22)35-3)16-29-11-13-30(14-12-29)17-23(31)27-21-6-4-5-18(15-21)26(32)28-20-8-9-20/h4-7,10,15,20H,8-9,11-14,16-17H2,1-3H3,(H,27,31)(H,28,32)/p+1