(2-cyanophenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: (2-cyanophenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (2-cyanobenzyl) ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2C#N)C

InChI

InChI=1S/C18H18N2O4S/c1-13-7-8-17(9-14(13)2)25(22,23)20-11-18(21)24-12-16-6-4-3-5-15(16)10-19/h3-9,20H,11-12H2,1-2H3