2-methoxy-2-[(3-nitrophenyl)methylsulfonyl]ethanoic acid

Systemtic Name: 2-methoxy-2-[(3-nitrophenyl)methylsulfonyl]ethanoic acid Openeye Name: 2-methoxy-2-[(3-nitrophenyl)methylsulfonyl]acetic acid CAS Name: 2-methoxy-2-[(3-nitrophenyl)methylsulfonyl]acetic acid IUPAC Name: 2-methoxy-2-[(3-nitrophenyl)methylsulfonyl]acetic acid Traditional Name: 2-methoxy-2-(3-nitrobenzyl)sulfonyl-acetic acid Formula: C10H11NO7S MolecularWeight: 289.26184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)O)S(=O)(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

COC(C(=O)O)S(=O)(=O)CC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C10H11NO7S/c1-18-10(9(12)13)19(16,17)6-7-3-2-4-8(5-7)11(14)15/h2-5,10H,6H2,1H3,(H,12,13)