1,3-benzodioxol-5-yl 2-methoxy-5-nitro-benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-methoxy-5-nitro-benzoate Openeye Name: 1,3-benzodioxol-5-yl 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid 1,3-benzodioxol-5-yl ester Formula: C15H11NO7 MolecularWeight: 317.25034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H11NO7/c1-20-12-4-2-9(16(18)19)6-11(12)15(17)23-10-3-5-13-14(7-10)22-8-21-13/h2-7H,8H2,1H3