(2E)-5,6-diethyl-2-(5-nitrosocyclohexa-2,4-dien-1-ylidene)-3-prop-2-ynyl-1H-pyrimidin-4-one

Systemtic Name: (2E)-5,6-diethyl-2-(5-nitrosocyclohexa-2,4-dien-1-ylidene)-3-prop-2-ynyl-1H-pyrimidin-4-one Openeye Name: (2E)-5,6-diethyl-2-(5-nitrosocyclohexa-2,4-dien-1-ylidene)-3-prop-2-ynyl-1H-pyrimidin-4-one CAS Name: (2E)-5,6-diethyl-2-(5-nitroso-1-cyclohexa-2,4-dienylidene)-3-prop-2-ynyl-1H-pyrimidin-4-one IUPAC Name: (2E)-5,6-diethyl-2-(5-nitrosocyclohexa-2,4-dien-1-ylidene)-3-prop-2-ynyl-1H-pyrimidin-4-one Traditional Name: (2E)-5,6-diethyl-2-(5-nitrosocyclohexa-2,4-dien-1-ylidene)-3-propargyl-1H-pyrimidin-4-one Formula: C17H19N3O2 MolecularWeight: 297.35166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=C2CC(=CC=C2)N=O)N(C1=O)CC#C)CC

Isomeric SMILES

CCC1=C(N/C(=C\2/CC(=CC=C2)N=O)/N(C1=O)CC#C)CC

InChI

InChI=1S/C17H19N3O2/c1-4-10-20-16(12-8-7-9-13(11-12)19-22)18-15(6-3)14(5-2)17(20)21/h1,7-9,18H,5-6,10-11H2,2-3H3/b16-12-