benzene; ethanenitrile; 4-methoxy-6-methyl-pyrimidine

Systemtic Name: benzene; ethanenitrile; 4-methoxy-6-methyl-pyrimidine Openeye Name: acetonitrile; benzene; 4-methoxy-6-methyl-pyrimidine CAS Name: acetonitrile; benzene; 4-methoxy-6-methylpyrimidine IUPAC Name: acetonitrile; benzene; 4-methoxy-6-methylpyrimidine Traditional Name: acetonitrile; benzene; 4-methoxy-6-methyl-pyrimidine Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC1=CC(=NC=N1)OC.C1=CC=CC=C1

Isomeric SMILES

CC#N.CC1=CC(=NC=N1)OC.C1=CC=CC=C1

InChI

InChI=1S/C6H8N2O.C6H6.C2H3N/c1-5-3-6(9-2)8-4-7-5;1-2-4-6-5-3-1;1-2-3/h3-4H,1-2H3;1-6H;1H3