N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-3-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)CCN2C(=O)COC3=C2C=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)CCN2C(=O)COC3=C2C=C(C=C3)C

InChI

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