2-(4-chloranyl-3-nitro-phenyl)-4-[[4-methoxy-3-(2-methylprop-2-enoxy)phenyl]methylidene]-1,3-oxazol-5-one

Systemtic Name: 2-(4-chloranyl-3-nitro-phenyl)-4-[[4-methoxy-3-(2-methylprop-2-enoxy)phenyl]methylidene]-1,3-oxazol-5-one Openeye Name: 2-(4-chloro-3-nitro-phenyl)-4-[[4-methoxy-3-(2-methylallyloxy)phenyl]methylene]oxazol-5-one CAS Name: 2-(4-chloro-3-nitrophenyl)-4-[[4-methoxy-3-(2-methylprop-2-enoxy)phenyl]methylidene]-5-oxazolone IUPAC Name: 2-(4-chloro-3-nitrophenyl)-4-[[4-methoxy-3-(2-methylprop-2-enoxy)phenyl]methylidene]-1,3-oxazol-5-one Traditional Name: 2-(4-chloro-3-nitro-phenyl)-4-[4-methoxy-3-(2-methylallyloxy)benzylidene]-2-oxazolin-5-one Formula: C21H17ClN2O6 MolecularWeight: 428.82248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CC(=C)COC1=C(C=CC(=C1)C=C2C(=O)OC(=N2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C21H17ClN2O6/c1-12(2)11-29-19-9-13(4-7-18(19)28-3)8-16-21(25)30-20(23-16)14-5-6-15(22)17(10-14)24(26)27/h4-10H,1,11H2,2-3H3