2-[(E)-2-(3-butoxy-4-methoxy-phenyl)ethenyl]-5-nitro-1,3-benzoxazole

Systemtic Name: 2-[(E)-2-(3-butoxy-4-methoxy-phenyl)ethenyl]-5-nitro-1,3-benzoxazole Openeye Name: 2-[(E)-2-(3-butoxy-4-methoxy-phenyl)vinyl]-5-nitro-1,3-benzoxazole CAS Name: 2-[(E)-2-(3-butoxy-4-methoxyphenyl)ethenyl]-5-nitro-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(3-butoxy-4-methoxyphenyl)ethenyl]-5-nitro-1,3-benzoxazole Traditional Name: 2-[(E)-2-(3-butoxy-4-methoxy-phenyl)vinyl]-5-nitro-1,3-benzoxazole Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=CC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C/C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H20N2O5/c1-3-4-11-26-19-12-14(5-8-18(19)25-2)6-10-20-21-16-13-15(22(23)24)7-9-17(16)27-20/h5-10,12-13H,3-4,11H2,1-2H3/b10-6+