(2S)-N-(4-ethoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: (2S)-N-(4-ethoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: (2S)-N-(4-ethoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2S)-N-(4-ethoxyphenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: (2S)-N-(4-ethoxyphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2S)-2-(4-methylpiperazine-1,4-diium-1-yl)-N-p-phenetyl-propionamide Formula: C16H27N3O2+2 MolecularWeight: 293.40448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H](C)[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C16H25N3O2/c1-4-21-15-7-5-14(6-8-15)17-16(20)13(2)19-11-9-18(3)10-12-19/h5-8,13H,4,9-12H2,1-3H3,(H,17,20)/p+2/t13-/m0/s1