(phenylmethyl) 6-[2-(2-hydroxyethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]hexanoate

Systemtic Name: (phenylmethyl) 6-[2-(2-hydroxyethyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]hexanoate Openeye Name: benzyl 6-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]hexanoate CAS Name: 6-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[2-(2-hydroxyethyl)-3-oxo-1,4-benzoxazin-4-yl]hexanoate Traditional Name: 6-[2-(2-hydroxyethyl)-3-keto-1,4-benzoxazin-4-yl]hexanoic acid benzyl ester Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCCCCN2C3=CC=CC=C3OC(C2=O)CCO

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCCCCN2C3=CC=CC=C3OC(C2=O)CCO

InChI

InChI=1S/C23H27NO5/c25-16-14-21-23(27)24(19-11-6-7-12-20(19)29-21)15-8-2-5-13-22(26)28-17-18-9-3-1-4-10-18/h1,3-4,6-7,9-12,21,25H,2,5,8,13-17H2