N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-methyl-5-propan-2-yl-4-isoxazolecarboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-3-methyl-5-propan-2-yl-1,2-oxazole-4-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-5-isopropyl-3-methyl-isoxazole-4-carboxamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)NC[C@@H](C2=CC=CO2)[NH+]3CCCCC3)C(C)C

InChI

InChI=1S/C19H27N3O3/c1-13(2)18-17(14(3)21-25-18)19(23)20-12-15(16-8-7-11-24-16)22-9-5-4-6-10-22/h7-8,11,13,15H,4-6,9-10,12H2,1-3H3,(H,20,23)/p+1/t15-/m0/s1