2-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: 2-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanoylamino]benzamide Openeye Name: 2-[[2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]acetyl]amino]benzamide CAS Name: 2-[[1-oxo-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]ethyl]amino]benzamide IUPAC Name: 2-[[2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]acetyl]amino]benzamide Traditional Name: 2-[[2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]acetyl]amino]benzamide Formula: C19H28N5O3+ MolecularWeight: 374.45732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)N

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C19H27N5O3/c20-19(27)15-5-1-2-6-16(15)21-17(25)13-22-9-11-23(12-10-22)14-18(26)24-7-3-4-8-24/h1-2,5-6H,3-4,7-14H2,(H2,20,27)(H,21,25)/p+1