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

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-propanamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-propanamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-phenylpropanamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-phenylpropanamide Traditional Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-phenyl-propionamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O/c1-17-16-19(24-14-12-23(2)13-15-24)9-10-20(17)22-21(25)11-8-18-6-4-3-5-7-18/h3-7,9-10,16H,8,11-15H2,1-2H3,(H,22,25)/p+1