(4-nitrophenyl) 2,4-bis(chloranyl)-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (4-nitrophenyl) 2,4-bis(chloranyl)-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (4-nitrophenyl) 2,4-dichloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2,4-dichloro-5-(1-piperidinylsulfonyl)benzoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2,4-dichloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-piperidinosulfonyl-benzoic acid (4-nitrophenyl) ester Formula: C18H16Cl2N2O6S MolecularWeight: 459.30044

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O6S/c19-15-11-16(20)17(29(26,27)21-8-2-1-3-9-21)10-14(15)18(23)28-13-6-4-12(5-7-13)22(24)25/h4-7,10-11H,1-3,8-9H2