2-[2-[(4R,5S)-5-ethanoyl-6-methylidene-2-oxidanylidene-1,3-diazinan-4-yl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-[(4R,5S)-5-ethanoyl-6-methylidene-2-oxidanylidene-1,3-diazinan-4-yl]phenoxy]ethanenitrile Openeye Name: 2-[2-[(4R,5S)-5-acetyl-6-methylene-2-oxo-hexahydropyrimidin-4-yl]phenoxy]acetonitrile CAS Name: 2-[2-[(4R,5S)-5-acetyl-6-methylene-2-oxo-1,3-diazinan-4-yl]phenoxy]acetonitrile IUPAC Name: 2-[2-[(4R,5S)-5-acetyl-6-methylidene-2-oxo-1,3-diazinan-4-yl]phenoxy]acetonitrile Traditional Name: 2-[2-[(4R,5S)-5-acetyl-2-keto-6-methylene-hexahydropyrimidin-4-yl]phenoxy]acetonitrile Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(NC(=O)NC1=C)C2=CC=CC=C2OCC#N

Isomeric SMILES

CC(=O)[C@H]1[C@@H](NC(=O)NC1=C)C2=CC=CC=C2OCC#N

InChI

InChI=1S/C15H15N3O3/c1-9-13(10(2)19)14(18-15(20)17-9)11-5-3-4-6-12(11)21-8-7-16/h3-6,13-14H,1,8H2,2H3,(H2,17,18,20)/t13-,14-/m0/s1