[(3S)-1-(2-acetamidoethanoyl)piperidin-3-yl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(3S)-1-(2-acetamidoethanoyl)piperidin-3-yl]-methyl-(phenylmethyl)azanium Openeye Name: [(3S)-1-(2-acetamidoacetyl)-3-piperidyl]-benzyl-methyl-ammonium CAS Name: [(3S)-1-(2-acetamido-1-oxoethyl)-3-piperidinyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [(3S)-1-(2-acetamidoacetyl)piperidin-3-yl]-benzyl-methylazanium Traditional Name: [(3S)-1-(2-acetamidoacetyl)-3-piperidyl]-benzyl-methyl-ammonium Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(=O)N1CCCC(C1)[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)NCC(=O)N1CCC[C@@H](C1)[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C17H25N3O2/c1-14(21)18-11-17(22)20-10-6-9-16(13-20)19(2)12-15-7-4-3-5-8-15/h3-5,7-8,16H,6,9-13H2,1-2H3,(H,18,21)/p+1/t16-/m0/s1