N-ethyl-3-[2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-ethyl-3-[2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanoylamino]benzamide Openeye Name: N-ethyl-3-[[2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide CAS Name: N-ethyl-3-[[1-oxo-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]ethyl]amino]benzamide IUPAC Name: N-ethyl-3-[[2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide Traditional Name: N-ethyl-3-[[2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetyl]amino]benzamide Formula: C23H32N4O3+2 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O3/c1-2-24-23(29)19-7-6-8-20(17-19)25-22(28)18-27-13-11-26(12-14-27)15-16-30-21-9-4-3-5-10-21/h3-10,17H,2,11-16,18H2,1H3,(H,24,29)(H,25,28)/p+2