N-[4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-3-methyl-benzamide Openeye Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-3-methyl-benzamide CAS Name: N-[4-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]phenyl]-2-methoxy-3-methylbenzamide IUPAC Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]-2-methoxy-3-methylbenzamide Traditional Name: N-[4-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]phenyl]-2-methoxy-3-methyl-benzamide Formula: C26H29ClN3O2+ MolecularWeight: 450.98036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C26H28ClN3O2/c1-19-6-5-8-23(25(19)32-2)26(31)28-21-10-12-22(13-11-21)30-16-14-29(15-17-30)18-20-7-3-4-9-24(20)27/h3-13H,14-18H2,1-2H3,(H,28,31)/p+1