(3-morpholin-4-ylsulfonylphenyl)methyl 2-(2-nitrophenoxy)ethanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-(2-nitrophenoxy)ethanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid (3-morpholinosulfonylbenzyl) ester Formula: C19H20N2O8S MolecularWeight: 436.4357

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O8S/c22-19(14-28-18-7-2-1-6-17(18)21(23)24)29-13-15-4-3-5-16(12-15)30(25,26)20-8-10-27-11-9-20/h1-7,12H,8-11,13-14H2