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

Systemtic Name: 3-(2,4-dimethylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Openeye Name: 3-(2,4-dimethylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide CAS Name: 3-(2,4-dimethylphenyl)-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-(2,4-dimethylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Traditional Name: 3-(2,4-dimethylphenyl)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propionamide Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)C

InChI

InChI=1S/C22H29N3O/c1-17-4-5-19(18(2)16-17)6-11-22(26)23-20-7-9-21(10-8-20)25-14-12-24(3)13-15-25/h4-5,7-10,16H,6,11-15H2,1-3H3,(H,23,26)/p+1