(4-nitrophenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Openeye Name: (4-nitrophenyl)methyl 3-[(4-isopropylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(4-propan-2-ylphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-cumenylsulfonylamino)propionic acid (4-nitrobenzyl) ester Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O6S/c1-14(2)16-5-9-18(10-6-16)28(25,26)20-12-11-19(22)27-13-15-3-7-17(8-4-15)21(23)24/h3-10,14,20H,11-13H2,1-2H3