[(2S)-3-methyl-1-oxidanylidene-1-(4-phenethylpiperazin-1-yl)butan-2-yl]azanium

Systemtic Name: [(2S)-3-methyl-1-oxidanylidene-1-(4-phenethylpiperazin-1-yl)butan-2-yl]azanium Openeye Name: [(1S)-2-methyl-1-(4-phenethylpiperazine-1-carbonyl)propyl]ammonium CAS Name: [(2S)-3-methyl-1-oxo-1-(4-phenethyl-1-piperazinyl)butan-2-yl]ammonium IUPAC Name: [(2S)-3-methyl-1-oxo-1-(4-phenethylpiperazin-1-yl)butan-2-yl]azanium Traditional Name: [(1S)-2-methyl-1-(4-phenethylpiperazine-1-carbonyl)propyl]ammonium Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)CCC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCN(CC1)CCC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C17H27N3O/c1-14(2)16(18)17(21)20-12-10-19(11-13-20)9-8-15-6-4-3-5-7-15/h3-7,14,16H,8-13,18H2,1-2H3/p+1/t16-/m0/s1