N-(2,6-dimethylphenyl)-2-[4-(2-methylprop-2-enyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylprop-2-enyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylallyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylprop-2-enyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylprop-2-enyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(2-methylallyl)piperazine-1,4-diium-1-yl]acetamide Formula: C18H29N3O+2 MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O/c1-14(2)12-20-8-10-21(11-9-20)13-17(22)19-18-15(3)6-5-7-16(18)4/h5-7H,1,8-13H2,2-4H3,(H,19,22)/p+2