3-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 3-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 3-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 3-[(3-keto-7-methyl-1,4-benzoxazin-4-yl)methyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C24H30N3O4+ MolecularWeight: 424.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=CC(=C3)C(=O)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=CC(=C3)C(=O)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C24H29N3O4/c1-18-6-7-21-22(14-18)31-17-23(28)27(21)16-19-4-2-5-20(15-19)24(29)25-8-3-9-26-10-12-30-13-11-26/h2,4-7,14-15H,3,8-13,16-17H2,1H3,(H,25,29)/p+1