(1-cyanoindolizin-2-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CN3C=CC=CC3=C2C#N

InChI

InChI=1S/C20H18N4O5S/c1-14(25)23-16-5-7-17(8-6-16)30(27,28)22-11-20(26)29-13-15-12-24-9-3-2-4-19(24)18(15)10-21/h2-9,12,22H,11,13H2,1H3,(H,23,25)