6-butanoyl-2,2-dimethyl-4-(2-methylprop-2-enyl)-1,4-benzoxazin-3-one

Systemtic Name: 6-butanoyl-2,2-dimethyl-4-(2-methylprop-2-enyl)-1,4-benzoxazin-3-one Openeye Name: 6-butanoyl-2,2-dimethyl-4-(2-methylallyl)-1,4-benzoxazin-3-one CAS Name: 2,2-dimethyl-4-(2-methylprop-2-enyl)-6-(1-oxobutyl)-1,4-benzoxazin-3-one IUPAC Name: 6-butanoyl-2,2-dimethyl-4-(2-methylprop-2-enyl)-1,4-benzoxazin-3-one Traditional Name: 6-butyryl-2,2-dimethyl-4-(2-methylallyl)-1,4-benzoxazin-3-one Formula: C18H23NO3 MolecularWeight: 301.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=C)C)(C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=C)C)(C)C

InChI

InChI=1S/C18H23NO3/c1-6-7-15(20)13-8-9-16-14(10-13)19(11-12(2)3)17(21)18(4,5)22-16/h8-10H,2,6-7,11H2,1,3-5H3