(4-nitrophenyl)methyl 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Openeye Name: (4-nitrophenyl)methyl 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-(mesitylsulfonylamino)propionic acid (4-nitrobenzyl) ester Formula: C19H22N2O6S MolecularWeight: 406.45278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H22N2O6S/c1-13-10-14(2)19(15(3)11-13)28(25,26)20-9-8-18(22)27-12-16-4-6-17(7-5-16)21(23)24/h4-7,10-11,20H,8-9,12H2,1-3H3