N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-[(2R)-2-cyano-3-methyl-butan-2-yl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-[(2R)-2-cyano-3-methylbutan-2-yl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-[(1R)-1-cyano-1,2-dimethyl-propyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H32N4O2+2 MolecularWeight: 360.49368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)C[NH+]1CC[NH+](CC1)CCOC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)C[NH+]1CC[NH+](CC1)CCOC2=CC=CC=C2

InChI

InChI=1S/C20H30N4O2/c1-17(2)20(3,16-21)22-19(25)15-24-11-9-23(10-12-24)13-14-26-18-7-5-4-6-8-18/h4-8,17H,9-15H2,1-3H3,(H,22,25)/p+2/t20-/m0/s1