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

Systemtic Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)-N-(2-methylphenyl)propanamide Openeye Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)-N-(o-tolyl)propanamide CAS Name: 3-(4-ethyl-1-piperazine-1,4-diiumyl)-N-(2-methylphenyl)propanamide IUPAC Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)-N-(2-methylphenyl)propanamide Traditional Name: 3-(4-ethylpiperazine-1,4-diium-1-yl)-N-(o-tolyl)propionamide Formula: C16H27N3O+2 MolecularWeight: 277.40508

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CCC(=O)NC2=CC=CC=C2C

InChI

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