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

Systemtic Name: N-[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]propanamide Openeye Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]propanamide CAS Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]phenyl]propanamide IUPAC Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]phenyl]propanamide Traditional Name: N-[3-chloro-4-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]phenyl]propionamide Formula: C20H24Cl2N3O+ MolecularWeight: 393.33006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N2CC[NH+](CC2)CC3=CC=CC=C3Cl)Cl

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N2CC[NH+](CC2)CC3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C20H23Cl2N3O/c1-2-20(26)23-16-7-8-19(18(22)13-16)25-11-9-24(10-12-25)14-15-5-3-4-6-17(15)21/h3-8,13H,2,9-12,14H2,1H3,(H,23,26)/p+1