(3S)-N-(2-methylprop-2-enyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(2-methylprop-2-enyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-N-(2-methylallyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(2-methylprop-2-enyl)-1-(1-propan-2-yl-4-piperidin-1-iumyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2-methylprop-2-enyl)-1-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-(1-isopropylpiperidin-1-ium-4-yl)-N-(2-methylallyl)piperidin-1-ium-3-carboxamide Formula: C18H35N3O+2 MolecularWeight: 309.49

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCC(=C)C

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCC(=C)C

InChI

InChI=1S/C18H33N3O/c1-14(2)12-19-18(22)16-6-5-9-21(13-16)17-7-10-20(11-8-17)15(3)4/h15-17H,1,5-13H2,2-4H3,(H,19,22)/p+2/t16-/m0/s1