methyl 5-methoxy-2-nitro-4-prop-2-enoxy-benzoate

Systemtic Name: methyl 5-methoxy-2-nitro-4-prop-2-enoxy-benzoate Openeye Name: methyl 4-allyloxy-5-methoxy-2-nitro-benzoate CAS Name: 5-methoxy-2-nitro-4-prop-2-enoxybenzoic acid methyl ester IUPAC Name: methyl 5-methoxy-2-nitro-4-prop-2-enoxybenzoate Traditional Name: 4-allyloxy-5-methoxy-2-nitro-benzoic acid methyl ester Formula: C12H13NO6 MolecularWeight: 267.23472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)[N+](=O)[O-])OCC=C

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)[N+](=O)[O-])OCC=C

InChI

InChI=1S/C12H13NO6/c1-4-5-19-11-7-9(13(15)16)8(12(14)18-3)6-10(11)17-2/h4,6-7H,1,5H2,2-3H3