2-[3-(6-bromanyl-5-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(6-bromanyl-5-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6-bromo-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6-bromo-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6-bromo-5-chloro-2-oxo-1,3-benzoxazol-3-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(6-bromo-5-chloro-2-keto-1,3-benzoxazol-3-yl)propyl]isoindoline-1,3-quinone Formula: C18H12BrClN2O4 MolecularWeight: 435.65588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C4=CC(=C(C=C4OC3=O)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C4=CC(=C(C=C4OC3=O)Br)Cl

InChI

InChI=1S/C18H12BrClN2O4/c19-12-8-15-14(9-13(12)20)21(18(25)26-15)6-3-7-22-16(23)10-4-1-2-5-11(10)17(22)24/h1-2,4-5,8-9H,3,6-7H2