(3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-4-piperidyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-4-piperidinyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]piperidin-4-yl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-cyclopropyl-1-[1-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]-4-piperidyl]piperidin-1-ium-3-carboxamide Formula: C19H33N5O+2 MolecularWeight: 347.49822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(N1)CN2CCC(CC2)[NH+]3CCCC(C3)C(=O)NC4CC4

Isomeric SMILES

CC1=C[NH+]=C(N1)CN2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NC4CC4

InChI

InChI=1S/C19H31N5O/c1-14-11-20-18(21-14)13-23-9-6-17(7-10-23)24-8-2-3-15(12-24)19(25)22-16-4-5-16/h11,15-17H,2-10,12-13H2,1H3,(H,20,21)(H,22,25)/p+2/t15-/m0/s1