2-(2-ethyl-6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide

Systemtic Name: 2-(2-ethyl-6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)ethanamide Openeye Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide CAS Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2-ethyl-6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Traditional Name: 2-(2-ethyl-3-keto-6-methyl-1,4-benzoxazin-4-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)acetamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)NCC[NH+]3CCCC3

Isomeric SMILES

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C)CC(=O)NCC[NH+]3CCCC3

InChI

InChI=1S/C19H27N3O3/c1-3-16-19(24)22(15-12-14(2)6-7-17(15)25-16)13-18(23)20-8-11-21-9-4-5-10-21/h6-7,12,16H,3-5,8-11,13H2,1-2H3,(H,20,23)/p+1