6-butanoyl-4-[2-(3-methylphenoxy)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-butanoyl-4-[2-(3-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-butanoyl-4-[2-(3-methylphenoxy)ethyl]-1,4-benzoxazin-3-one CAS Name: 4-[2-(3-methylphenoxy)ethyl]-6-(1-oxobutyl)-1,4-benzoxazin-3-one IUPAC Name: 6-butanoyl-4-[2-(3-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-butyryl-4-[2-(3-methylphenoxy)ethyl]-1,4-benzoxazin-3-one Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCOC3=CC=CC(=C3)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCOC3=CC=CC(=C3)C

InChI

InChI=1S/C21H23NO4/c1-3-5-19(23)16-8-9-20-18(13-16)22(21(24)14-26-20)10-11-25-17-7-4-6-15(2)12-17/h4,6-9,12-13H,3,5,10-11,14H2,1-2H3