4-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]butyl]benzamide

Systemtic Name: 4-chloranyl-N-[4-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]butyl]benzamide Openeye Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]butyl]benzamide CAS Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]butyl]benzamide IUPAC Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]butyl]benzamide Traditional Name: 4-chloro-N-[4-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]butyl]benzamide Formula: C22H29ClN3O2+ MolecularWeight: 402.93756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O2/c1-28-21-7-3-2-6-20(21)26-16-14-25(15-17-26)13-5-4-12-24-22(27)18-8-10-19(23)11-9-18/h2-3,6-11H,4-5,12-17H2,1H3,(H,24,27)/p+1