N-[4-[2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]ethanoyl]phenyl]benzamide

Systemtic Name: N-[4-[2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-1-yl]ethanoyl]phenyl]benzamide Openeye Name: N-[4-[2-[4-(2-morpholino-2-oxo-ethyl)piperazin-4-ium-1-yl]acetyl]phenyl]benzamide CAS Name: N-[4-[2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-4-iumyl]-1-oxoethyl]phenyl]benzamide IUPAC Name: N-[4-[2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-1-yl]acetyl]phenyl]benzamide Traditional Name: N-[4-[2-[4-(2-keto-2-morpholino-ethyl)piperazin-4-ium-1-yl]acetyl]phenyl]benzamide Formula: C25H31N4O4+ MolecularWeight: 451.53804

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCOCC2)CC(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O4/c30-23(20-6-8-22(9-7-20)26-25(32)21-4-2-1-3-5-21)18-27-10-12-28(13-11-27)19-24(31)29-14-16-33-17-15-29/h1-9H,10-19H2,(H,26,32)/p+1