methyl 4-(1-azanylpropoxy)-5-methoxy-2-nitro-benzoate

Systemtic Name: methyl 4-(1-azanylpropoxy)-5-methoxy-2-nitro-benzoate Openeye Name: methyl 4-(1-aminopropoxy)-5-methoxy-2-nitro-benzoate CAS Name: 4-(1-aminopropoxy)-5-methoxy-2-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-(1-aminopropoxy)-5-methoxy-2-nitrobenzoate Traditional Name: 4-(1-aminopropoxy)-5-methoxy-2-nitro-benzoic acid methyl ester Formula: C12H16N2O6 MolecularWeight: 284.26524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N)OC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OC)OC

Isomeric SMILES

CCC(N)OC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)OC)OC

InChI

InChI=1S/C12H16N2O6/c1-4-11(13)20-10-6-8(14(16)17)7(12(15)19-3)5-9(10)18-2/h5-6,11H,4,13H2,1-3H3