4-[(E)-2-nitroethenyl]-2-pentoxy-phenol

Systemtic Name: 4-[(E)-2-nitroethenyl]-2-pentoxy-phenol Openeye Name: 4-[(E)-2-nitrovinyl]-2-pentoxy-phenol CAS Name: 4-[(E)-2-nitroethenyl]-2-pentoxyphenol IUPAC Name: 4-[(E)-2-nitroethenyl]-2-pentoxyphenol Traditional Name: 2-amoxy-4-[(E)-2-nitrovinyl]phenol Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)C=C[N+](=O)[O-])O

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])O

InChI

InChI=1S/C13H17NO4/c1-2-3-4-9-18-13-10-11(5-6-12(13)15)7-8-14(16)17/h5-8,10,15H,2-4,9H2,1H3/b8-7+