2-(2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: 2-(2-ethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide CAS Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2-ethyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-(2-ethyl-3-keto-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC[NH+]3CCCC3

Isomeric SMILES

CCC1C(=O)N(C2=CC=CC=C2O1)CC(=O)NCC[NH+]3CCCC3

InChI

InChI=1S/C18H25N3O3/c1-2-15-18(23)21(14-7-3-4-8-16(14)24-15)13-17(22)19-9-12-20-10-5-6-11-20/h3-4,7-8,15H,2,5-6,9-13H2,1H3,(H,19,22)/p+1