2-(5-cyano-4-methyl-2-naphthalen-1-yl-6-oxidanylidene-pyrimidin-1-yl)ethanoic acid

Systemtic Name: 2-(5-cyano-4-methyl-2-naphthalen-1-yl-6-oxidanylidene-pyrimidin-1-yl)ethanoic acid Openeye Name: 2-[5-cyano-4-methyl-2-(1-naphthyl)-6-oxo-pyrimidin-1-yl]acetic acid CAS Name: 2-[5-cyano-4-methyl-2-(1-naphthalenyl)-6-oxo-1-pyrimidinyl]acetic acid IUPAC Name: 2-(5-cyano-4-methyl-2-naphthalen-1-yl-6-oxopyrimidin-1-yl)acetic acid Traditional Name: 2-[5-cyano-6-keto-4-methyl-2-(1-naphthyl)pyrimidin-1-yl]acetic acid Formula: C18H13N3O3 MolecularWeight: 319.31412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)C2=CC=CC3=CC=CC=C32)CC(=O)O)C#N

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)C2=CC=CC3=CC=CC=C32)CC(=O)O)C#N

InChI

InChI=1S/C18H13N3O3/c1-11-15(9-19)18(24)21(10-16(22)23)17(20-11)14-8-4-6-12-5-2-3-7-13(12)14/h2-8H,10H2,1H3,(H,22,23)