methyl 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]ethanoate Openeye Name: methyl 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]acetate CAS Name: 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]acetate Traditional Name: 2-[3-[(E)-2-nitroprop-1-enyl]phenoxy]acetic acid methyl ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)OCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)OCC(=O)OC)/[N+](=O)[O-]

InChI

InChI=1S/C12H13NO5/c1-9(13(15)16)6-10-4-3-5-11(7-10)18-8-12(14)17-2/h3-7H,8H2,1-2H3/b9-6+