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

Systemtic Name: N-cyclopropyl-2-[2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-2-[[2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-2-[[2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-2-[[2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-2-[[2-[4-(2-keto-2-morpholino-ethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C22H32N5O4+ MolecularWeight: 430.52058

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC(=O)N4CCOCC4

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C22H31N5O4/c28-20(24-19-4-2-1-3-18(19)22(30)23-17-5-6-17)15-25-7-9-26(10-8-25)16-21(29)27-11-13-31-14-12-27/h1-4,17H,5-16H2,(H,23,30)(H,24,28)/p+1