[4-(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl] propanoate

Systemtic Name: [4-(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl] propanoate Openeye Name: [4-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)phenyl] propanoate CAS Name: propanoic acid [4-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)phenyl] ester IUPAC Name: [4-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)phenyl] propanoate Traditional Name: propionic acid [4-(6-bromo-4-keto-3,1-benzoxazin-2-yl)phenyl] ester Formula: C17H12BrNO4 MolecularWeight: 374.18548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=O)O2

Isomeric SMILES

CCC(=O)OC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=O)O2

InChI

InChI=1S/C17H12BrNO4/c1-2-15(20)22-12-6-3-10(4-7-12)16-19-14-8-5-11(18)9-13(14)17(21)23-16/h3-9H,2H2,1H3