N-[2-(azepan-1-ium-1-yl)ethyl]-5-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide

Systemtic Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide Openeye Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(4-methoxyphenyl)oxazole-4-carboxamide CAS Name: N-[2-(1-azepan-1-iumyl)ethyl]-5-(4-methoxyphenyl)-4-oxazolecarboxamide IUPAC Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide Traditional Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(4-methoxyphenyl)oxazole-4-carboxamide Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N=CO2)C(=O)NCC[NH+]3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N=CO2)C(=O)NCC[NH+]3CCCCCC3

InChI

InChI=1S/C19H25N3O3/c1-24-16-8-6-15(7-9-16)18-17(21-14-25-18)19(23)20-10-13-22-11-4-2-3-5-12-22/h6-9,14H,2-5,10-13H2,1H3,(H,20,23)/p+1