6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[[(E)-but-2-enoyl]amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(1-azanyl-1-oxidanylidene-hexadecan-3-yl)oxy-5-[[(E)-but-2-enoyl]amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1-(2-amino-2-oxo-ethyl)tetradecoxy]-5-[[(E)-but-2-enoyl]amino]-6-oxo-hexanoic acid CAS Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-6-oxo-5-[[(E)-1-oxobut-2-enyl]amino]hexanoic acid IUPAC Name: 6-(1-amino-1-oxohexadecan-3-yl)oxy-5-[[(E)-but-2-enoyl]amino]-6-oxohexanoic acid Traditional Name: 6-[1-(2-amino-2-keto-ethyl)tetradecoxy]-5-[[(E)-but-2-enoyl]amino]-6-keto-hexanoic acid Formula: C26H46N2O6 MolecularWeight: 482.65324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)C=CC

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)N)OC(=O)C(CCCC(=O)O)NC(=O)/C=C/C

InChI

InChI=1S/C26H46N2O6/c1-3-5-6-7-8-9-10-11-12-13-14-17-21(20-23(27)29)34-26(33)22(18-15-19-25(31)32)28-24(30)16-4-2/h4,16,21-22H,3,5-15,17-20H2,1-2H3,(H2,27,29)(H,28,30)(H,31,32)/b16-4+