N-(3-bromanyl-4-methyl-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-(3-bromanyl-4-methyl-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(3-bromo-4-methyl-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(3-bromo-4-methylphenyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(3-bromo-4-methylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(3-bromo-4-methyl-phenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C15H24BrN3O+2 MolecularWeight: 342.27456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC[NH+]2CC[NH+](CC2)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC[NH+]2CC[NH+](CC2)C)Br

InChI

InChI=1S/C15H22BrN3O/c1-12-3-4-13(11-14(12)16)17-15(20)5-6-19-9-7-18(2)8-10-19/h3-4,11H,5-10H2,1-2H3,(H,17,20)/p+2