4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzaldehyde

Systemtic Name: 4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzaldehyde Openeye Name: 4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]benzaldehyde CAS Name: 4-[(E)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]benzaldehyde IUPAC Name: 4-[(E)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]benzaldehyde Traditional Name: 4-[(E)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]benzaldehyde Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CC2=CC=C(C=C2)C=O

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C/C2=CC=C(C=C2)C=O

InChI

InChI=1S/C13H10N2O4/c1-9-13(15(17)18)12(19-14-9)7-6-10-2-4-11(8-16)5-3-10/h2-8H,1H3/b7-6+