N-[(2R)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]butan-2-yl]ethanamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperazin-4-ium-1-yl]butan-2-yl]ethanamide Openeye Name: N-[(1R)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-methyl-propyl]acetamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[4-(phenylmethyl)-1-piperazin-4-iumyl]butan-2-yl]acetamide IUPAC Name: N-[(2R)-1-(4-benzylpiperazin-4-ium-1-yl)-3-methyl-1-oxobutan-2-yl]acetamide Traditional Name: N-[(1R)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-methyl-propyl]acetamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C)[C@H](C(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C18H27N3O2/c1-14(2)17(19-15(3)22)18(23)21-11-9-20(10-12-21)13-16-7-5-4-6-8-16/h4-8,14,17H,9-13H2,1-3H3,(H,19,22)/p+1/t17-/m1/s1