5-azanyl-2-[(4-cyanophenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(4-cyanophenyl)sulfonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4-cyanophenyl)sulfonylamino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(4-cyanophenyl)sulfonylamino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(4-cyanophenyl)sulfonylamino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[(4-cyanophenyl)sulfonylamino]-5-keto-valeric acid Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C12H13N3O5S/c13-7-8-1-3-9(4-2-8)21(19,20)15-10(12(17)18)5-6-11(14)16/h1-4,10,15H,5-6H2,(H2,14,16)(H,17,18)