(2R)-6-butanoyl-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: (2R)-6-butanoyl-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one Openeye Name: (2R)-6-butanoyl-2-methyl-4-(p-tolylmethyl)-1,4-benzoxazin-3-one CAS Name: (2R)-2-methyl-4-[(4-methylphenyl)methyl]-6-(1-oxobutyl)-1,4-benzoxazin-3-one IUPAC Name: (2R)-6-butanoyl-2-methyl-4-[(4-methylphenyl)methyl]-1,4-benzoxazin-3-one Traditional Name: (2R)-6-butyryl-2-methyl-4-(4-methylbenzyl)-1,4-benzoxazin-3-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC3=CC=C(C=C3)C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H23NO3/c1-4-5-19(23)17-10-11-20-18(12-17)22(21(24)15(3)25-20)13-16-8-6-14(2)7-9-16/h6-12,15H,4-5,13H2,1-3H3/t15-/m1/s1