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

Systemtic Name: 3-[(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Openeye Name: 3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide CAS Name: 3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-[2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 3-[(6-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Traditional Name: 3-[(3-keto-6-methyl-1,4-benzoxazin-4-yl)methyl]-N-(2-morpholin-4-ium-4-ylethyl)benzamide Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C23H27N3O4/c1-17-5-6-21-20(13-17)26(22(27)16-30-21)15-18-3-2-4-19(14-18)23(28)24-7-8-25-9-11-29-12-10-25/h2-6,13-14H,7-12,15-16H2,1H3,(H,24,28)/p+1