N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(4-methoxyphenyl)propanamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propanamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)propionamide Formula: C21H27ClN3O2+ MolecularWeight: 388.91098

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H26ClN3O2/c1-24-11-13-25(14-12-24)20-9-6-17(22)15-19(20)23-21(26)10-5-16-3-7-18(27-2)8-4-16/h3-4,6-9,15H,5,10-14H2,1-2H3,(H,23,26)/p+1