sodium (E)-2-[(2,2-dimethylcyclopropyl)carbonylamino]oct-2-enoate

Systemtic Name: sodium (E)-2-[(2,2-dimethylcyclopropyl)carbonylamino]oct-2-enoate Openeye Name: sodium (E)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoate CAS Name: sodium (E)-2-[[(2,2-dimethylcyclopropyl)-oxomethyl]amino]-2-octenoate IUPAC Name: sodium (E)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoate Traditional Name: sodium (E)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoate Formula: C14H22NNaO3 MolecularWeight: 275.31915

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=C(C(=O)[O-])NC(=O)C1CC1(C)C.[Na+]

Isomeric SMILES

CCCCC/C=C(\C(=O)[O-])/NC(=O)C1CC1(C)C.[Na+]

InChI

InChI=1S/C14H23NO3.Na/c1-4-5-6-7-8-11(13(17)18)15-12(16)10-9-14(10,2)3;/h8,10H,4-7,9H2,1-3H3,(H,15,16)(H,17,18);/q;+1/p-1/b11-8+;