(2-azanylpyridin-1-ium-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone

Systemtic Name: (2-azanylpyridin-1-ium-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Openeye Name: (2-aminopyridin-1-ium-4-yl)-[(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidin-1-yl]methanone CAS Name: (2-amino-4-pyridin-1-iumyl)-[(3R)-3-[1-(2-methylpropyl)-4-piperidin-1-iumyl]-1-pyrrolidinyl]methanone IUPAC Name: (2-aminopyridin-1-ium-4-yl)-[(3R)-3-[1-(2-methylpropyl)piperidin-1-ium-4-yl]pyrrolidin-1-yl]methanone Traditional Name: (2-aminopyridin-1-ium-4-yl)-[(3R)-3-(1-isobutylpiperidin-1-ium-4-yl)pyrrolidino]methanone Formula: C19H32N4O+2 MolecularWeight: 332.48358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(CC1)C2CCN(C2)C(=O)C3=CC(=[NH+]C=C3)N

Isomeric SMILES

CC(C)C[NH+]1CCC(CC1)[C@H]2CCN(C2)C(=O)C3=CC(=[NH+]C=C3)N

InChI

InChI=1S/C19H30N4O/c1-14(2)12-22-8-4-15(5-9-22)17-6-10-23(13-17)19(24)16-3-7-21-18(20)11-16/h3,7,11,14-15,17H,4-6,8-10,12-13H2,1-2H3,(H2,20,21)/p+2/t17-/m0/s1