8-[(2-ethoxycarbonyl-5-oxidanylidene-undecanoyl)amino]oct-4-ynoic acid

Systemtic Name: 8-[(2-ethoxycarbonyl-5-oxidanylidene-undecanoyl)amino]oct-4-ynoic acid Openeye Name: 8-[(2-ethoxycarbonyl-5-oxo-undecanoyl)amino]oct-4-ynoic acid CAS Name: 8-[(2-ethoxycarbonyl-1,5-dioxoundecyl)amino]-4-octynoic acid IUPAC Name: 8-[(2-ethoxycarbonyl-5-oxoundecanoyl)amino]oct-4-ynoic acid Traditional Name: 8-[(2-carbethoxy-5-keto-undecanoyl)amino]oct-4-ynoic acid Formula: C22H35NO6 MolecularWeight: 409.5164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CCC(C(=O)NCCCC#CCCC(=O)O)C(=O)OCC

Isomeric SMILES

CCCCCCC(=O)CCC(C(=O)NCCCC#CCCC(=O)O)C(=O)OCC

InChI

InChI=1S/C22H35NO6/c1-3-5-6-10-13-18(24)15-16-19(22(28)29-4-2)21(27)23-17-12-9-7-8-11-14-20(25)26/h19H,3-6,9-17H2,1-2H3,(H,23,27)(H,25,26)