2-ethoxy-N-[3-[4-[3-[(2-ethoxyphenyl)carbonylamino]propyl]piperazin-1-ium-1-yl]propyl]benzamide

Systemtic Name: 2-ethoxy-N-[3-[4-[3-[(2-ethoxyphenyl)carbonylamino]propyl]piperazin-1-ium-1-yl]propyl]benzamide Openeye Name: 2-ethoxy-N-[3-[4-[3-[(2-ethoxybenzoyl)amino]propyl]piperazin-1-ium-1-yl]propyl]benzamide CAS Name: 2-ethoxy-N-[3-[4-[3-[[(2-ethoxyphenyl)-oxomethyl]amino]propyl]-1-piperazin-1-iumyl]propyl]benzamide IUPAC Name: 2-ethoxy-N-[3-[4-[3-[(2-ethoxybenzoyl)amino]propyl]piperazin-1-ium-1-yl]propyl]benzamide Traditional Name: 2-ethoxy-N-[3-[4-[3-[(2-ethoxybenzoyl)amino]propyl]piperazin-1-ium-1-yl]propyl]benzamide Formula: C28H41N4O4+ MolecularWeight: 497.64954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NCCC[NH+]2CCN(CC2)CCCNC(=O)C3=CC=CC=C3OCC

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NCCC[NH+]2CCN(CC2)CCCNC(=O)C3=CC=CC=C3OCC

InChI

InChI=1S/C28H40N4O4/c1-3-35-25-13-7-5-11-23(25)27(33)29-15-9-17-31-19-21-32(22-20-31)18-10-16-30-28(34)24-12-6-8-14-26(24)36-4-2/h5-8,11-14H,3-4,9-10,15-22H2,1-2H3,(H,29,33)(H,30,34)/p+1