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

Systemtic Name: methyl-[(2S)-3-methyl-1-oxidanylidene-1-piperazin-1-yl-butan-2-yl]-(1-methylpiperidin-4-yl)azanium Openeye Name: methyl-[(1S)-2-methyl-1-(piperazine-1-carbonyl)propyl]-(1-methyl-4-piperidyl)ammonium CAS Name: methyl-[(2S)-3-methyl-1-oxo-1-(1-piperazinyl)butan-2-yl]-(1-methyl-4-piperidinyl)ammonium IUPAC Name: methyl-[(2S)-3-methyl-1-oxo-1-piperazin-1-ylbutan-2-yl]-(1-methylpiperidin-4-yl)azanium Traditional Name: methyl-[(1S)-2-methyl-1-(piperazine-1-carbonyl)propyl]-(1-methyl-4-piperidyl)ammonium Formula: C16H33N4O+ MolecularWeight: 297.45942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCNCC1)[NH+](C)C2CCN(CC2)C

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCNCC1)[NH+](C)C2CCN(CC2)C

InChI

InChI=1S/C16H32N4O/c1-13(2)15(16(21)20-11-7-17-8-12-20)19(4)14-5-9-18(3)10-6-14/h13-15,17H,5-12H2,1-4H3/p+1/t15-/m0/s1