(3S)-N-[2-[1-(2,2-dimethyl-3-oxidanyl-propyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide

Systemtic Name: (3S)-N-[2-[1-(2,2-dimethyl-3-oxidanyl-propyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Openeye Name: (3S)-N-[2-[1-(3-hydroxy-2,2-dimethyl-propyl)piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide CAS Name: (3S)-N-[2-[1-(3-hydroxy-2,2-dimethylpropyl)-4-piperidin-1-iumyl]-3-pyrazolyl]-3-oxolanecarboxamide IUPAC Name: (3S)-N-[2-[1-(3-hydroxy-2,2-dimethylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Traditional Name: (3S)-N-[2-[1-(3-hydroxy-2,2-dimethyl-propyl)piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide Formula: C18H31N4O3+ MolecularWeight: 351.46374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)C3CCOC3)CO

Isomeric SMILES

CC(C)(C[NH+]1CCC(CC1)N2C(=CC=N2)NC(=O)[C@H]3CCOC3)CO

InChI

InChI=1S/C18H30N4O3/c1-18(2,13-23)12-21-8-4-15(5-9-21)22-16(3-7-19-22)20-17(24)14-6-10-25-11-14/h3,7,14-15,23H,4-6,8-13H2,1-2H3,(H,20,24)/p+1/t14-/m0/s1