4-[(5-chloranyl-2-methoxy-phenyl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[(5-chloro-2-methoxy-phenyl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[(5-chloro-2-methoxyphenyl)methyl]-N-propyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(5-chloro-2-methoxyphenyl)methyl]-N-propylpiperazin-4-ium-1-carboxamide Traditional Name: 4-(5-chloro-2-methoxy-benzyl)-N-propyl-piperazin-4-ium-1-carboxamide Formula: C16H25ClN3O2+ MolecularWeight: 326.8416

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CC[NH+](CC1)CC2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCCNC(=O)N1CC[NH+](CC1)CC2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C16H24ClN3O2/c1-3-6-18-16(21)20-9-7-19(8-10-20)12-13-11-14(17)4-5-15(13)22-2/h4-5,11H,3,6-10,12H2,1-2H3,(H,18,21)/p+1