methyl 2-[2-[2-(4-heptyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenyl]ethanoate

Systemtic Name: methyl 2-[2-[2-(4-heptyl-3-oxidanylidene-1,4-benzoxazin-2-yl)ethoxy]phenyl]ethanoate Openeye Name: methyl 2-[2-[2-(4-heptyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetate CAS Name: 2-[2-[2-(4-heptyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(4-heptyl-3-oxo-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetate Traditional Name: 2-[2-[2-(4-heptyl-3-keto-1,4-benzoxazin-2-yl)ethoxy]phenyl]acetic acid methyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)OC

Isomeric SMILES

CCCCCCCN1C2=CC=CC=C2OC(C1=O)CCOC3=CC=CC=C3CC(=O)OC

InChI

InChI=1S/C26H33NO5/c1-3-4-5-6-11-17-27-21-13-8-10-15-23(21)32-24(26(27)29)16-18-31-22-14-9-7-12-20(22)19-25(28)30-2/h7-10,12-15,24H,3-6,11,16-19H2,1-2H3