propyl 5-acetamido-4-nitro-2-propoxy-benzoate

Systemtic Name: propyl 5-acetamido-4-nitro-2-propoxy-benzoate Openeye Name: propyl 5-acetamido-4-nitro-2-propoxy-benzoate CAS Name: 5-acetamido-4-nitro-2-propoxybenzoic acid propyl ester IUPAC Name: propyl 5-acetamido-4-nitro-2-propoxybenzoate Traditional Name: 5-acetamido-4-nitro-2-propoxy-benzoic acid propyl ester Formula: C15H20N2O6 MolecularWeight: 324.3291

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1C(=O)OCCC)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC(=C(C=C1C(=O)OCCC)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O6/c1-4-6-22-14-9-13(17(20)21)12(16-10(3)18)8-11(14)15(19)23-7-5-2/h8-9H,4-7H2,1-3H3,(H,16,18)