N-cyclopropyl-1-[2-[(2R)-1-(quinolin-5-ylmethyl)piperidin-1-ium-2-yl]ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-cyclopropyl-1-[2-[(2R)-1-(quinolin-5-ylmethyl)piperidin-1-ium-2-yl]ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-cyclopropyl-1-[2-[(2R)-1-(5-quinolylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide CAS Name: N-cyclopropyl-1-[2-[(2R)-1-(5-quinolinylmethyl)-2-piperidin-1-iumyl]ethyl]-4-triazolecarboxamide IUPAC Name: N-cyclopropyl-1-[2-[(2R)-1-(quinolin-5-ylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide Traditional Name: N-cyclopropyl-1-[2-[(2R)-1-(5-quinolylmethyl)piperidin-1-ium-2-yl]ethyl]triazole-4-carboxamide Formula: C23H29N6O+ MolecularWeight: 405.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CCN2C=C(N=N2)C(=O)NC3CC3)CC4=C5C=CC=NC5=CC=C4

Isomeric SMILES

C1CC[NH+]([C@H](C1)CCN2C=C(N=N2)C(=O)NC3CC3)CC4=C5C=CC=NC5=CC=C4

InChI

InChI=1S/C23H28N6O/c30-23(25-18-9-10-18)22-16-29(27-26-22)14-11-19-6-1-2-13-28(19)15-17-5-3-8-21-20(17)7-4-12-24-21/h3-5,7-8,12,16,18-19H,1-2,6,9-11,13-15H2,(H,25,30)/p+1/t19-/m1/s1