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

Systemtic Name: 2-(6-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)-N-(4-pyridylmethyl)acetamide CAS Name: 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-[2-(4-morpholin-4-iumyl)ethyl]-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-(6-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-(3-keto-6-methyl-1,4-benzoxazin-4-yl)-N-(2-morpholin-4-ium-4-ylethyl)-N-(4-pyridylmethyl)acetamide Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=O)N2CC(=O)N(CC[NH+]3CCOCC3)CC4=CC=NC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=O)N2CC(=O)N(CC[NH+]3CCOCC3)CC4=CC=NC=C4

InChI

InChI=1S/C23H28N4O4/c1-18-2-3-21-20(14-18)27(23(29)17-31-21)16-22(28)26(15-19-4-6-24-7-5-19)9-8-25-10-12-30-13-11-25/h2-7,14H,8-13,15-17H2,1H3/p+1