(2-pentanoyloxyphenyl) 4-nitrobenzoate

Systemtic Name: (2-pentanoyloxyphenyl) 4-nitrobenzoate Openeye Name: (2-pentanoyloxyphenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(1-oxopentoxy)phenyl] ester IUPAC Name: (2-pentanoyloxyphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-valeryloxyphenyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)OC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

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