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

Systemtic Name: 2-[(E)-2-(3-methoxy-4-prop-2-enoxy-phenyl)ethenyl]-5-nitro-1,3-benzoxazole Openeye Name: 2-[(E)-2-(4-allyloxy-3-methoxy-phenyl)vinyl]-5-nitro-1,3-benzoxazole CAS Name: 2-[(E)-2-(3-methoxy-4-prop-2-enoxyphenyl)ethenyl]-5-nitro-1,3-benzoxazole IUPAC Name: 2-[(E)-2-(3-methoxy-4-prop-2-enoxyphenyl)ethenyl]-5-nitro-1,3-benzoxazole Traditional Name: 2-[(E)-2-(4-allyloxy-3-methoxy-phenyl)vinyl]-5-nitro-1,3-benzoxazole Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C19H16N2O5/c1-3-10-25-17-7-4-13(11-18(17)24-2)5-9-19-20-15-12-14(21(22)23)6-8-16(15)26-19/h3-9,11-12H,1,10H2,2H3/b9-5+