6-[2-azanyl-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-[(4-nitrophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(4-methoxyphenoxy)-1H-pyrimidin-6-ylidene]-3-(4-nitrobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C24H20N4O6 MolecularWeight: 460.4388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC=C(C=C4)[N+](=O)[O-])N

Isomeric SMILES

COC1=CC=C(C=C1)OC2=CN=C(NC2=C3C=CC(=CC3=O)OCC4=CC=C(C=C4)[N+](=O)[O-])N

InChI

InChI=1S/C24H20N4O6/c1-32-17-6-8-18(9-7-17)34-22-13-26-24(25)27-23(22)20-11-10-19(12-21(20)29)33-14-15-2-4-16(5-3-15)28(30)31/h2-13H,14H2,1H3,(H3,25,26,27)