2-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)butanoic acid

Systemtic Name: 2-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)butanoic acid Openeye Name: 2-(4-morpholinosulfonylphenyl)-4-(4-nitrophenyl)butanoic acid CAS Name: 2-[4-(4-morpholinylsulfonyl)phenyl]-4-(4-nitrophenyl)butanoic acid IUPAC Name: 2-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)butanoic acid Traditional Name: 2-(4-morpholinosulfonylphenyl)-4-(4-nitrophenyl)butyric acid Formula: C20H22N2O7S MolecularWeight: 434.46288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(CCC3=CC=C(C=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H22N2O7S/c23-20(24)19(10-3-15-1-6-17(7-2-15)22(25)26)16-4-8-18(9-5-16)30(27,28)21-11-13-29-14-12-21/h1-2,4-9,19H,3,10-14H2,(H,23,24)