(3S)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[2-(2-imidazo[1,2-a]pyridinyl)ethyl]-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(2-imidazo[1,2-a]pyridin-2-ylethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-carboxamide Formula: C21H33N5O+2 MolecularWeight: 371.51962

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C21H31N5O/c1-24-13-8-19(9-14-24)25-12-4-5-17(15-25)21(27)22-10-7-18-16-26-11-3-2-6-20(26)23-18/h2-3,6,11,16-17,19H,4-5,7-10,12-15H2,1H3,(H,22,27)/p+2/t17-/m0/s1