6-bromanyl-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dione

Systemtic Name: 6-bromanyl-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dione Openeye Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dione CAS Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dione IUPAC Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dione Traditional Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-quinone Formula: C21H22BrNO3 MolecularWeight: 416.30828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C21H22BrNO3/c1-2-3-4-5-6-7-15-8-11-17(12-9-15)23-20(24)18-14-16(22)10-13-19(18)26-21(23)25/h8-14H,2-7H2,1H3