4-bromanyl-1-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyrrole-2-carbonitrile

Systemtic Name: 4-bromanyl-1-(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)pyrrole-2-carbonitrile Openeye Name: 4-bromo-1-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyrrole-2-carbonitrile CAS Name: 4-bromo-1-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)-2-pyrrolecarbonitrile IUPAC Name: 4-bromo-1-(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)pyrrole-2-carbonitrile Traditional Name: 4-bromo-1-(2-keto-4,4-dimethyl-1H-3,1-benzoxazin-6-yl)pyrrole-2-carbonitrile Formula: C15H12BrN3O2 MolecularWeight: 346.17868

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=CC(=C2)N3C=C(C=C3C#N)Br)NC(=O)O1)C

Isomeric SMILES

CC1(C2=C(C=CC(=C2)N3C=C(C=C3C#N)Br)NC(=O)O1)C

InChI

InChI=1S/C15H12BrN3O2/c1-15(2)12-6-10(3-4-13(12)18-14(20)21-15)19-8-9(16)5-11(19)7-17/h3-6,8H,1-2H3,(H,18,20)