(3S)-N-[2-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide

Systemtic Name: (3S)-N-[2-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Openeye Name: (3S)-N-[2-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide CAS Name: (3S)-N-[2-[1-(4-dibenzofuranylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]-3-oxolanecarboxamide IUPAC Name: (3S)-N-[2-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide Traditional Name: (3S)-N-[2-[1-(dibenzofuran-4-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]tetrahydrofuran-3-carboxamide Formula: C26H29N4O3+ MolecularWeight: 445.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3CCOC3)CC4=CC=CC5=C4OC6=CC=CC=C56

Isomeric SMILES

C1COC[C@H]1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CC4=CC=CC5=C4OC6=CC=CC=C56

InChI

InChI=1S/C26H28N4O3/c31-26(19-11-15-32-17-19)28-24-8-12-27-30(24)20-9-13-29(14-10-20)16-18-4-3-6-22-21-5-1-2-7-23(21)33-25(18)22/h1-8,12,19-20H,9-11,13-17H2,(H,28,31)/p+1/t19-/m0/s1