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

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-(3,4,5-trimethoxyphenyl)propionamide Formula: C23H31ClN3O4+ MolecularWeight: 448.96294

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H30ClN3O4/c1-26-9-11-27(12-10-26)19-7-6-17(24)15-18(19)25-22(28)8-5-16-13-20(29-2)23(31-4)21(14-16)30-3/h6-7,13-15H,5,8-12H2,1-4H3,(H,25,28)/p+1