N-(2,5-dimethylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(2,5-dimethylphenyl)-3-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C16H27N3O+2 MolecularWeight: 277.40508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-13-4-5-14(2)15(12-13)17-16(20)6-7-19-10-8-18(3)9-11-19/h4-5,12H,6-11H2,1-3H3,(H,17,20)/p+2