2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-(furan-2-ylmethyl)benzamide

Systemtic Name: 2-[2-(4-ethanoylpiperazin-1-ium-1-yl)ethanoylamino]-N-(furan-2-ylmethyl)benzamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2-furylmethyl)benzamide CAS Name: 2-[[2-(4-acetyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-N-(2-furanylmethyl)benzamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(furan-2-ylmethyl)benzamide Traditional Name: 2-[[2-(4-acetylpiperazin-1-ium-1-yl)acetyl]amino]-N-(2-furfuryl)benzamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H24N4O4/c1-15(25)24-10-8-23(9-11-24)14-19(26)22-18-7-3-2-6-17(18)20(27)21-13-16-5-4-12-28-16/h2-7,12H,8-11,13-14H2,1H3,(H,21,27)(H,22,26)/p+1