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

Systemtic Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide Openeye Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(2-naphthyl)oxazole-4-carboxamide CAS Name: N-[2-(1-azepan-1-iumyl)ethyl]-5-(2-naphthalenyl)-4-oxazolecarboxamide IUPAC Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide Traditional Name: N-[2-(azepan-1-ium-1-yl)ethyl]-5-(2-naphthyl)oxazole-4-carboxamide Formula: C22H26N3O2+ MolecularWeight: 364.46074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCNC(=O)C2=C(OC=N2)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCC[NH+](CC1)CCNC(=O)C2=C(OC=N2)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H25N3O2/c26-22(23-11-14-25-12-5-1-2-6-13-25)20-21(27-16-24-20)19-10-9-17-7-3-4-8-18(17)15-19/h3-4,7-10,15-16H,1-2,5-6,11-14H2,(H,23,26)/p+1