methyl 2-[(3-cyanophenyl)sulfonylamino]-2-methyl-pentanoate

Systemtic Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-2-methyl-pentanoate Openeye Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-2-methyl-pentanoate CAS Name: 2-[(3-cyanophenyl)sulfonylamino]-2-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3-cyanophenyl)sulfonylamino]-2-methylpentanoate Traditional Name: 2-[(3-cyanophenyl)sulfonylamino]-2-methyl-valeric acid methyl ester Formula: C14H18N2O4S MolecularWeight: 310.36872

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(=O)OC)NS(=O)(=O)C1=CC=CC(=C1)C#N

Isomeric SMILES

CCCC(C)(C(=O)OC)NS(=O)(=O)C1=CC=CC(=C1)C#N

InChI

InChI=1S/C14H18N2O4S/c1-4-8-14(2,13(17)20-3)16-21(18,19)12-7-5-6-11(9-12)10-15/h5-7,9,16H,4,8H2,1-3H3