2-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopentyl-benzamide

Systemtic Name: 2-[2-[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-ium-1-yl]ethanoylamino]-N-cyclopentyl-benzamide Openeye Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentyl-benzamide CAS Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]-1-piperazin-1-iumyl]-1-oxoethyl]amino]-N-cyclopentylbenzamide IUPAC Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentylbenzamide Traditional Name: 2-[[2-[4-[2-(4-chlorophenoxy)ethyl]piperazin-1-ium-1-yl]acetyl]amino]-N-cyclopentyl-benzamide Formula: C26H34ClN4O3+ MolecularWeight: 486.02616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCN(CC3)CCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H33ClN4O3/c27-20-9-11-22(12-10-20)34-18-17-30-13-15-31(16-14-30)19-25(32)29-24-8-4-3-7-23(24)26(33)28-21-5-1-2-6-21/h3-4,7-12,21H,1-2,5-6,13-19H2,(H,28,33)(H,29,32)/p+1