3-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide

Systemtic Name: 3-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide Openeye Name: 3-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide CAS Name: 3-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(4-morpholin-4-iumyl)ethyl]propanamide IUPAC Name: 3-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)propanamide Traditional Name: 3-(3-keto-6-methyl-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)propionamide Formula: C18H26N3O4+ MolecularWeight: 348.41674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CCC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CCC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C18H25N3O4/c1-14-2-3-16-15(12-14)21(18(23)13-25-16)6-4-17(22)19-5-7-20-8-10-24-11-9-20/h2-3,12H,4-11,13H2,1H3,(H,19,22)/p+1