(2R)-N-aminocarbonyl-2-(azepan-1-ium-1-yl)-2-phenyl-ethanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-(azepan-1-ium-1-yl)-2-phenyl-ethanamide Openeye Name: (2R)-2-(azepan-1-ium-1-yl)-N-carbamoyl-2-phenyl-acetamide CAS Name: (2R)-2-(1-azepan-1-iumyl)-N-carbamoyl-2-phenylacetamide IUPAC Name: (2R)-2-(azepan-1-ium-1-yl)-N-carbamoyl-2-phenylacetamide Traditional Name: (2R)-2-(azepan-1-ium-1-yl)-N-carbamoyl-2-phenyl-acetamide Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C(C2=CC=CC=C2)C(=O)NC(=O)N

Isomeric SMILES

C1CCC[NH+](CC1)[C@H](C2=CC=CC=C2)C(=O)NC(=O)N

InChI

InChI=1S/C15H21N3O2/c16-15(20)17-14(19)13(12-8-4-3-5-9-12)18-10-6-1-2-7-11-18/h3-5,8-9,13H,1-2,6-7,10-11H2,(H3,16,17,19,20)/p+1/t13-/m1/s1