N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-ethyl-1,2-oxazole-5-carboxamide

Systemtic Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-ethyl-1,2-oxazole-5-carboxamide Openeye Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-ethyl-isoxazole-5-carboxamide CAS Name: N-[(3S)-1-(cyclohexylmethyl)-3-piperidin-1-iumyl]-3-ethyl-5-isoxazolecarboxamide IUPAC Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-ethyl-1,2-oxazole-5-carboxamide Traditional Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-3-ethyl-isoxazole-5-carboxamide Formula: C18H30N3O2+ MolecularWeight: 320.4497

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1)C(=O)NC2CCC[NH+](C2)CC3CCCCC3

Isomeric SMILES

CCC1=NOC(=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3CCCCC3

InChI

InChI=1S/C18H29N3O2/c1-2-15-11-17(23-20-15)18(22)19-16-9-6-10-21(13-16)12-14-7-4-3-5-8-14/h11,14,16H,2-10,12-13H2,1H3,(H,19,22)/p+1/t16-/m0/s1