(3S)-1-[1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-4-yl]-N-(phenylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-4-yl]-N-(phenylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-benzyl-1-[1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-[(1-ethyl-2-imidazolyl)methyl]-4-piperidin-1-iumyl]-N-(phenylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-benzyl-1-[1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-benzyl-1-[1-[(1-ethylimidazol-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide Formula: C24H37N5O+2 MolecularWeight: 411.58348

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN=C1C[NH+]2CCC(CC2)[NH+]3CCCC(C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCN1C=CN=C1C[NH+]2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H35N5O/c1-2-28-16-12-25-23(28)19-27-14-10-22(11-15-27)29-13-6-9-21(18-29)24(30)26-17-20-7-4-3-5-8-20/h3-5,7-8,12,16,21-22H,2,6,9-11,13-15,17-19H2,1H3,(H,26,30)/p+2/t21-/m0/s1