(4-methyl-3-nitro-2-propoxy-phenyl) ethanoate

Systemtic Name: (4-methyl-3-nitro-2-propoxy-phenyl) ethanoate Openeye Name: (4-methyl-3-nitro-2-propoxy-phenyl) acetate CAS Name: acetic acid (4-methyl-3-nitro-2-propoxyphenyl) ester IUPAC Name: (4-methyl-3-nitro-2-propoxyphenyl) acetate Traditional Name: acetic acid (4-methyl-3-nitro-2-propoxy-phenyl) ester Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=CC(=C1[N+](=O)[O-])C)OC(=O)C

Isomeric SMILES

CCCOC1=C(C=CC(=C1[N+](=O)[O-])C)OC(=O)C

InChI

InChI=1S/C12H15NO5/c1-4-7-17-12-10(18-9(3)14)6-5-8(2)11(12)13(15)16/h5-6H,4,7H2,1-3H3