N-[5-bromanyl-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-oxidanylidene-pyridin-3-yl]ethanamide

Systemtic Name: N-[5-bromanyl-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-oxidanylidene-pyridin-3-yl]ethanamide Openeye Name: N-[5-bromo-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-oxo-3-pyridyl]acetamide CAS Name: N-[5-bromo-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-oxo-3-pyridinyl]acetamide IUPAC Name: N-[5-bromo-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-oxopyridin-3-yl]acetamide Traditional Name: N-[5-bromo-1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-6-keto-3-pyridyl]acetamide Formula: C18H15BrN4O3 MolecularWeight: 415.2407

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN(C(=O)C(=C1)Br)C2=NC(OC3=C2C=C(C=C3)C#N)(C)C

Isomeric SMILES

CC(=O)NC1=CN(C(=O)C(=C1)Br)C2=NC(OC3=C2C=C(C=C3)C#N)(C)C

InChI

InChI=1S/C18H15BrN4O3/c1-10(24)21-12-7-14(19)17(25)23(9-12)16-13-6-11(8-20)4-5-15(13)26-18(2,3)22-16/h4-7,9H,1-3H3,(H,21,24)