[(2S,3S)-3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-3-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]azanium Openeye Name: [(1S,2S)-2-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]ammonium CAS Name: [(2S,3S)-3-methyl-1-oxo-1-(4-phenyl-1-piperazinyl)pentan-2-yl]ammonium IUPAC Name: [(2S,3S)-3-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]azanium Traditional Name: [(1S,2S)-2-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]ammonium Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-3-13(2)15(17)16(20)19-11-9-18(10-12-19)14-7-5-4-6-8-14/h4-8,13,15H,3,9-12,17H2,1-2H3/p+1/t13-,15-/m0/s1