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

Systemtic Name: N-(2,5-dimethylphenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: N-(2,5-dimethylphenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide CAS Name: N-(2,5-dimethylphenyl)-3-(4-ethyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: N-(2,5-dimethylphenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: N-(2,5-dimethylphenyl)-3-(4-ethylpiperazine-1,4-diium-1-yl)propionamide Formula: C17H29N3O+2 MolecularWeight: 291.43166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C17H27N3O/c1-4-19-9-11-20(12-10-19)8-7-17(21)18-16-13-14(2)5-6-15(16)3/h5-6,13H,4,7-12H2,1-3H3,(H,18,21)/p+2