N-[5-bromanyl-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-oxidanylidene-pyridin-3-yl]ethanamide

Systemtic Name: N-[5-bromanyl-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-oxidanylidene-pyridin-3-yl]ethanamide Openeye Name: N-[5-bromo-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-oxo-3-pyridyl]acetamide CAS Name: N-[5-bromo-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-oxo-3-pyridinyl]acetamide IUPAC Name: N-[5-bromo-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-oxopyridin-3-yl]acetamide Traditional Name: N-[5-bromo-1-(7-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-6-keto-3-pyridyl]acetamide Formula: C20H18BrN3O2 MolecularWeight: 412.27982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN(C(=O)C(=C1)Br)C2=CC(CC3=C2C=C(C=C3)C#N)(C)C

Isomeric SMILES

CC(=O)NC1=CN(C(=O)C(=C1)Br)C2=CC(CC3=C2C=C(C=C3)C#N)(C)C

InChI

InChI=1S/C20H18BrN3O2/c1-12(25)23-15-7-17(21)19(26)24(11-15)18-9-20(2,3)8-14-5-4-13(10-22)6-16(14)18/h4-7,9,11H,8H2,1-3H3,(H,23,25)