6-bromanyl-7-(4-methylphenyl)carbonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-bromanyl-7-(4-methylphenyl)carbonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-bromo-7-(4-methylbenzoyl)-4H-1,4-benzoxazin-3-one CAS Name: 6-bromo-7-[(4-methylphenyl)-oxomethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-bromo-7-(4-methylbenzoyl)-4H-1,4-benzoxazin-3-one Traditional Name: 6-bromo-7-p-toluoyl-4H-1,4-benzoxazin-3-one Formula: C16H12BrNO3 MolecularWeight: 346.17538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2Br)NC(=O)CO3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC3=C(C=C2Br)NC(=O)CO3

InChI

InChI=1S/C16H12BrNO3/c1-9-2-4-10(5-3-9)16(20)11-6-14-13(7-12(11)17)18-15(19)8-21-14/h2-7H,8H2,1H3,(H,18,19)