(4-propylsulfonylphenyl)methyl 4-(2-chloranyl-4-nitro-phenoxy)benzoate

Systemtic Name: (4-propylsulfonylphenyl)methyl 4-(2-chloranyl-4-nitro-phenoxy)benzoate Openeye Name: (4-propylsulfonylphenyl)methyl 4-(2-chloro-4-nitro-phenoxy)benzoate CAS Name: 4-(2-chloro-4-nitrophenoxy)benzoic acid (4-propylsulfonylphenyl)methyl ester IUPAC Name: (4-propylsulfonylphenyl)methyl 4-(2-chloro-4-nitrophenoxy)benzoate Traditional Name: 4-(2-chloro-4-nitro-phenoxy)benzoic acid (4-propylsulfonylbenzyl) ester Formula: C23H20ClNO7S MolecularWeight: 489.9254

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CCCS(=O)(=O)C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H20ClNO7S/c1-2-13-33(29,30)20-10-3-16(4-11-20)15-31-23(26)17-5-8-19(9-6-17)32-22-12-7-18(25(27)28)14-21(22)24/h3-12,14H,2,13,15H2,1H3