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

Systemtic Name: N-cyclopentyl-2-[2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-cyclopentyl-2-[[2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-cyclopentyl-2-[[1-oxo-2-[4-(2-phenoxyethyl)-1-piperazin-1-iumyl]ethyl]amino]benzamide IUPAC Name: N-cyclopentyl-2-[[2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-cyclopentyl-2-[[2-[4-(2-phenoxyethyl)piperazin-1-ium-1-yl]acetyl]amino]benzamide Formula: C26H35N4O3+ MolecularWeight: 451.5811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N4O3/c31-25(28-24-13-7-6-12-23(24)26(32)27-21-8-4-5-9-21)20-30-16-14-29(15-17-30)18-19-33-22-10-2-1-3-11-22/h1-3,6-7,10-13,21H,4-5,8-9,14-20H2,(H,27,32)(H,28,31)/p+1