(3-nitrophenyl)methyl 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3-nitrophenyl)methyl 2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3-nitrophenyl)methyl 2,4-dichloro-5-morpholinosulfonyl-benzoate CAS Name: 2,4-dichloro-5-(4-morpholinylsulfonyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 2,4-dichloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2,4-dichloro-5-morpholinosulfonyl-benzoic acid (3-nitrobenzyl) ester Formula: C18H16Cl2N2O7S MolecularWeight: 475.29984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C(C(=C2)C(=O)OCC3=CC(=CC=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O7S/c19-15-10-16(20)17(30(26,27)21-4-6-28-7-5-21)9-14(15)18(23)29-11-12-2-1-3-13(8-12)22(24)25/h1-3,8-10H,4-7,11H2