ethyl 3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]-3-(prop-2-enoxycarbonylamino)propanoate

Systemtic Name: ethyl 3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]-3-(prop-2-enoxycarbonylamino)propanoate Openeye Name: ethyl 3-(allyloxycarbonylamino)-3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]propanoate CAS Name: 3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]-3-[[oxo(prop-2-enoxy)methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]-3-(prop-2-enoxycarbonylamino)propanoate Traditional Name: 3-(allyloxycarbonylamino)-3-[3-[(3-nitrophenyl)sulfonylamino]phenyl]propionic acid ethyl ester Formula: C21H23N3O8S MolecularWeight: 477.48762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])NC(=O)OCC=C

Isomeric SMILES

CCOC(=O)CC(C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])NC(=O)OCC=C

InChI

InChI=1S/C21H23N3O8S/c1-3-11-32-21(26)22-19(14-20(25)31-4-2)15-7-5-8-16(12-15)23-33(29,30)18-10-6-9-17(13-18)24(27)28/h3,5-10,12-13,19,23H,1,4,11,14H2,2H3,(H,22,26)