(4-propoxycarbonylphenyl) 3-nitrobenzoate

Systemtic Name: (4-propoxycarbonylphenyl) 3-nitrobenzoate Openeye Name: (4-propoxycarbonylphenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[oxo(propoxy)methyl]phenyl] ester IUPAC Name: (4-propoxycarbonylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-propoxycarbonylphenyl) ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-2-10-23-16(19)12-6-8-15(9-7-12)24-17(20)13-4-3-5-14(11-13)18(21)22/h3-9,11H,2,10H2,1H3