4-[3,4-bis(bromanyl)pyridin-2-yl]oxy-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile

Systemtic Name: 4-[3,4-bis(bromanyl)pyridin-2-yl]oxy-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Openeye Name: 4-[(3,4-dibromo-2-pyridyl)oxy]-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile CAS Name: 4-[(3,4-dibromo-2-pyridinyl)oxy]-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile IUPAC Name: 4-(3,4-dibromopyridin-2-yl)oxy-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Traditional Name: 4-[(3,4-dibromo-2-pyridyl)oxy]-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Formula: C16H11Br2N3O2 MolecularWeight: 437.08544

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)OC3=NC=CC(=C3Br)Br)C

Isomeric SMILES

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)OC3=NC=CC(=C3Br)Br)C

InChI

InChI=1S/C16H11Br2N3O2/c1-16(2)21-14(22-15-13(18)11(17)5-6-20-15)10-7-9(8-19)3-4-12(10)23-16/h3-7H,1-2H3