4-[(4,4-dihexyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butyl ethanoate

Systemtic Name: 4-[(4,4-dihexyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butyl ethanoate Openeye Name: 4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butyl acetate CAS Name: acetic acid 4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butyl ester IUPAC Name: 4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butyl acetate Traditional Name: acetic acid 4-[(4,4-dihexyl-2-keto-1H-3,1-benzoxazin-6-yl)oxy]butyl ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=C(C=CC(=C2)OCCCCOC(=O)C)NC(=O)O1)CCCCCC

Isomeric SMILES

CCCCCCC1(C2=C(C=CC(=C2)OCCCCOC(=O)C)NC(=O)O1)CCCCCC

InChI

InChI=1S/C26H41NO5/c1-4-6-8-10-16-26(17-11-9-7-5-2)23-20-22(14-15-24(23)27-25(29)32-26)31-19-13-12-18-30-21(3)28/h14-15,20H,4-13,16-19H2,1-3H3,(H,27,29)