(E)-4-oxidanylidene-4-[12-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]dodecylamino]but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-[12-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]dodecylamino]but-2-enoic acid Openeye Name: (E)-4-[12-[[(E)-4-hydroxy-4-oxo-but-2-enoyl]amino]dodecylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[12-[[(E)-4-hydroxy-1,4-dioxobut-2-enyl]amino]dodecylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[12-[[(E)-4-hydroxy-4-oxobut-2-enoyl]amino]dodecylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[12-[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]dodecylamino]-4-keto-but-2-enoic acid Formula: C20H32N2O6 MolecularWeight: 396.47788

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCNC(=O)C=CC(=O)O)CCCCCNC(=O)C=CC(=O)O

Isomeric SMILES

C(CCCCCNC(=O)/C=C/C(=O)O)CCCCCCNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C20H32N2O6/c23-17(11-13-19(25)26)21-15-9-7-5-3-1-2-4-6-8-10-16-22-18(24)12-14-20(27)28/h11-14H,1-10,15-16H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/b13-11+,14-12+