2-[[(E)-5-azanyl-2-methylidene-5-oxidanylidene-pent-3-enoyl]amino]butane-2-sulfonic acid

Systemtic Name: 2-[[(E)-5-azanyl-2-methylidene-5-oxidanylidene-pent-3-enoyl]amino]butane-2-sulfonic acid Openeye Name: 2-[[(E)-5-amino-2-methylene-5-oxo-pent-3-enoyl]amino]butane-2-sulfonic acid CAS Name: 2-[[(E)-5-amino-2-methylene-1,5-dioxopent-3-enyl]amino]-2-butanesulfonic acid IUPAC Name: 2-[[(E)-5-amino-2-methylidene-5-oxopent-3-enoyl]amino]butane-2-sulfonic acid Traditional Name: 2-[[(E)-5-amino-5-keto-2-methylene-pent-3-enoyl]amino]butane-2-sulfonic acid Formula: C10H16N2O5S MolecularWeight: 276.30944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(NC(=O)C(=C)C=CC(=O)N)S(=O)(=O)O

Isomeric SMILES

CCC(C)(NC(=O)C(=C)/C=C/C(=O)N)S(=O)(=O)O

InChI

InChI=1S/C10H16N2O5S/c1-4-10(3,18(15,16)17)12-9(14)7(2)5-6-8(11)13/h5-6H,2,4H2,1,3H3,(H2,11,13)(H,12,14)(H,15,16,17)/b6-5+