6-(cyclohexylamino)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-(cyclohexylamino)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Openeye Name: 6-(cyclohexylamino)-N-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide CAS Name: 6-(cyclohexylamino)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-(cyclohexylamino)-N-[(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Traditional Name: 6-(cyclohexylamino)-N-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]pyridin-1-ium-3-carboxamide Formula: C18H26N5O2+ MolecularWeight: 344.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NO1)CNC(=O)C2=C[NH+]=C(C=C2)NC3CCCCC3

Isomeric SMILES

CC(C)C1=NC(=NO1)CNC(=O)C2=C[NH+]=C(C=C2)NC3CCCCC3

InChI

InChI=1S/C18H25N5O2/c1-12(2)18-22-16(23-25-18)11-20-17(24)13-8-9-15(19-10-13)21-14-6-4-3-5-7-14/h8-10,12,14H,3-7,11H2,1-2H3,(H,19,21)(H,20,24)/p+1