2-[(4-cyanophenyl)sulfonylamino]-5-ethyl-benzoic acid

Systemtic Name: 2-[(4-cyanophenyl)sulfonylamino]-5-ethyl-benzoic acid Openeye Name: 2-[(4-cyanophenyl)sulfonylamino]-5-ethyl-benzoic acid CAS Name: 2-[(4-cyanophenyl)sulfonylamino]-5-ethylbenzoic acid IUPAC Name: 2-[(4-cyanophenyl)sulfonylamino]-5-ethylbenzoic acid Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]-5-ethyl-benzoic acid Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C16H14N2O4S/c1-2-11-5-8-15(14(9-11)16(19)20)18-23(21,22)13-6-3-12(10-17)4-7-13/h3-9,18H,2H2,1H3,(H,19,20)