(4-butoxycarbonylphenyl) 3-nitrobenzoate

Systemtic Name: (4-butoxycarbonylphenyl) 3-nitrobenzoate Openeye Name: (4-butoxycarbonylphenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[butoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-butoxycarbonylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-butoxycarbonylphenyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO6/c1-2-3-11-24-17(20)13-7-9-16(10-8-13)25-18(21)14-5-4-6-15(12-14)19(22)23/h4-10,12H,2-3,11H2,1H3