diethyl-[(4S)-4-[[(3S,6R)-6-methylpiperidin-1-ium-3-yl]carbonylamino]pentyl]azanium

Systemtic Name: diethyl-[(4S)-4-[[(3S,6R)-6-methylpiperidin-1-ium-3-yl]carbonylamino]pentyl]azanium Openeye Name: diethyl-[(4S)-4-[[(3S,6R)-6-methylpiperidin-1-ium-3-carbonyl]amino]pentyl]ammonium CAS Name: diethyl-[(4S)-4-[[[(3S,6R)-6-methyl-3-piperidin-1-iumyl]-oxomethyl]amino]pentyl]ammonium IUPAC Name: diethyl-[(4S)-4-[[(3S,6R)-6-methylpiperidin-1-ium-3-carbonyl]amino]pentyl]azanium Traditional Name: diethyl-[(4S)-4-[[(3S,6R)-6-methylpiperidin-1-ium-3-carbonyl]amino]pentyl]ammonium Formula: C16H35N3O+2 MolecularWeight: 285.4686

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)NC(=O)C1CCC([NH2+]C1)C

Isomeric SMILES

CC[NH+](CC)CCC[C@H](C)NC(=O)[C@H]1CC[C@H]([NH2+]C1)C

InChI

InChI=1S/C16H33N3O/c1-5-19(6-2)11-7-8-14(4)18-16(20)15-10-9-13(3)17-12-15/h13-15,17H,5-12H2,1-4H3,(H,18,20)/p+2/t13-,14+,15+/m1/s1