pentyl 2-[2-methyl-6-[(E)-2-(4-nitrophenyl)ethenyl]-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate

Systemtic Name: pentyl 2-[2-methyl-6-[(E)-2-(4-nitrophenyl)ethenyl]-4-oxidanylidene-1H-pyrimidin-5-yl]hexanoate Openeye Name: pentyl 2-[2-methyl-6-[(E)-2-(4-nitrophenyl)vinyl]-4-oxo-1H-pyrimidin-5-yl]hexanoate CAS Name: 2-[2-methyl-6-[(E)-2-(4-nitrophenyl)ethenyl]-4-oxo-1H-pyrimidin-5-yl]hexanoic acid pentyl ester IUPAC Name: pentyl 2-[2-methyl-6-[(E)-2-(4-nitrophenyl)ethenyl]-4-oxo-1H-pyrimidin-5-yl]hexanoate Traditional Name: 2-[4-keto-2-methyl-6-[(E)-2-(4-nitrophenyl)vinyl]-1H-pyrimidin-5-yl]hexanoic acid amyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)C)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C24H31N3O5/c1-4-6-8-16-32-24(29)20(9-7-5-2)22-21(25-17(3)26-23(22)28)15-12-18-10-13-19(14-11-18)27(30)31/h10-15,20H,4-9,16H2,1-3H3,(H,25,26,28)/b15-12+