4-cyano-2,2-bis(2-cyanoethyl)butane-1-sulfonic acid

Systemtic Name: 4-cyano-2,2-bis(2-cyanoethyl)butane-1-sulfonic acid Openeye Name: 4-cyano-2,2-bis(2-cyanoethyl)butane-1-sulfonic acid CAS Name: 4-cyano-2,2-bis(2-cyanoethyl)-1-butanesulfonic acid IUPAC Name: 4-cyano-2,2-bis(2-cyanoethyl)butane-1-sulfonic acid Traditional Name: 4-cyano-2,2-bis(2-cyanoethyl)butane-1-sulfonic acid Formula: C11H15N3O3S MolecularWeight: 269.3201

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(CCC#N)(CCC#N)CS(=O)(=O)O)C#N

Isomeric SMILES

C(CC(CCC#N)(CCC#N)CS(=O)(=O)O)C#N

InChI

InChI=1S/C11H15N3O3S/c12-7-1-4-11(5-2-8-13,6-3-9-14)10-18(15,16)17/h1-6,10H2,(H,15,16,17)