(3S)-1-[1-[(E)-4-methylpent-2-enyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[1-[(E)-4-methylpent-2-enyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-[(E)-4-methylpent-2-enyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[(E)-4-methylpent-2-enyl]-4-piperidin-1-iumyl]-N-(3-pyridinylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-[(E)-4-methylpent-2-enyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-[(E)-4-methylpent-2-enyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidin-1-ium-3-carboxamide Formula: C23H38N4O+2 MolecularWeight: 386.57402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=CC[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)/C=C/C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C23H36N4O/c1-19(2)6-4-12-26-14-9-22(10-15-26)27-13-5-8-21(18-27)23(28)25-17-20-7-3-11-24-16-20/h3-4,6-7,11,16,19,21-22H,5,8-10,12-15,17-18H2,1-2H3,(H,25,28)/p+2/b6-4+/t21-/m0/s1