5-[(E)-2-(4-ethylphenyl)ethenyl]-3-nitro-2-oxidanyl-benzaldehyde

Systemtic Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-3-nitro-2-oxidanyl-benzaldehyde Openeye Name: 5-[(E)-2-(4-ethylphenyl)vinyl]-2-hydroxy-3-nitro-benzaldehyde CAS Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-2-hydroxy-3-nitrobenzaldehyde IUPAC Name: 5-[(E)-2-(4-ethylphenyl)ethenyl]-2-hydroxy-3-nitrobenzaldehyde Traditional Name: 5-[(E)-2-(4-ethylphenyl)vinyl]-2-hydroxy-3-nitro-benzaldehyde Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC2=CC(=C(C(=C2)[N+](=O)[O-])O)C=O

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C2=CC(=C(C(=C2)[N+](=O)[O-])O)C=O

InChI

InChI=1S/C17H15NO4/c1-2-12-3-5-13(6-4-12)7-8-14-9-15(11-19)17(20)16(10-14)18(21)22/h3-11,20H,2H2,1H3/b8-7+