methyl 5-[4-[2-(2-hydroxyethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylate

Systemtic Name: methyl 5-[4-[2-(2-hydroxyethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylate Openeye Name: methyl 5-[4-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylate CAS Name: 5-[4-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[4-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylate Traditional Name: 5-[4-[2-(2-hydroxyethyl)-3-keto-1,4-benzoxazin-4-yl]butyl]-2-methyl-1,3-dioxane-2-carboxylic acid methyl ester Formula: C21H29NO7 MolecularWeight: 407.45746

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)CCCCN2C3=CC=CC=C3OC(C2=O)CCO)C(=O)OC

Isomeric SMILES

CC1(OCC(CO1)CCCCN2C3=CC=CC=C3OC(C2=O)CCO)C(=O)OC

InChI

InChI=1S/C21H29NO7/c1-21(20(25)26-2)27-13-15(14-28-21)7-5-6-11-22-16-8-3-4-9-17(16)29-18(10-12-23)19(22)24/h3-4,8-9,15,18,23H,5-7,10-14H2,1-2H3