N-[3-(azepan-1-ium-1-yl)propyl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-ium-1-yl)propyl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[3-(azepan-1-ium-1-yl)propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[3-(1-azepan-1-iumyl)propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[3-(azepan-1-ium-1-yl)propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[3-(azepan-1-ium-1-yl)propyl]-2-(3-keto-1,4-benzoxazin-4-yl)acetamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCCNC(=O)CN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

C1CCC[NH+](CC1)CCCNC(=O)CN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C19H27N3O3/c23-18(20-10-7-13-21-11-5-1-2-6-12-21)14-22-16-8-3-4-9-17(16)25-15-19(22)24/h3-4,8-9H,1-2,5-7,10-15H2,(H,20,23)/p+1