(2-propoxyphenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (2-propoxyphenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (2-propoxyphenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (2-propoxyphenyl) ester IUPAC Name: (2-propoxyphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (2-propoxyphenyl) ester Formula: C16H14ClNO5 MolecularWeight: 335.73906

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClNO5/c1-2-9-22-14-5-3-4-6-15(14)23-16(19)11-7-8-12(17)13(10-11)18(20)21/h3-8,10H,2,9H2,1H3