(E)-8-(2-carboxyethylamino)-2-[(2,2-dimethylcyclopropyl)carbonylamino]oct-2-enoic acid

Systemtic Name: (E)-8-(2-carboxyethylamino)-2-[(2,2-dimethylcyclopropyl)carbonylamino]oct-2-enoic acid Openeye Name: (E)-8-(2-carboxyethylamino)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoic acid CAS Name: (E)-8-(2-carboxyethylamino)-2-[[(2,2-dimethylcyclopropyl)-oxomethyl]amino]-2-octenoic acid IUPAC Name: (E)-8-(2-carboxyethylamino)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoic acid Traditional Name: (E)-8-(2-carboxyethylamino)-2-[(2,2-dimethylcyclopropanecarbonyl)amino]oct-2-enoic acid Formula: C17H28N2O5 MolecularWeight: 340.41462

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1C(=O)NC(=CCCCCCNCCC(=O)O)C(=O)O)C

Isomeric SMILES

CC1(CC1C(=O)N/C(=C/CCCCCNCCC(=O)O)/C(=O)O)C

InChI

InChI=1S/C17H28N2O5/c1-17(2)11-12(17)15(22)19-13(16(23)24)7-5-3-4-6-9-18-10-8-14(20)21/h7,12,18H,3-6,8-11H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)/b13-7+