(Z)-4-[2-[[(Z)-octadec-9-enoyl]amino]-4-oxidanyl-butoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-4-[2-[[(Z)-octadec-9-enoyl]amino]-4-oxidanyl-butoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-4-[4-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]butoxy]-4-oxo-but-2-enoic acid CAS Name: (Z)-4-[4-hydroxy-2-[[(Z)-1-oxooctadec-9-enyl]amino]butoxy]-4-oxo-2-butenoic acid IUPAC Name: (Z)-4-[4-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]butoxy]-4-oxobut-2-enoic acid Traditional Name: (Z)-4-[4-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]butoxy]-4-keto-but-2-enoic acid Formula: C26H45NO6 MolecularWeight: 467.6386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC(CCO)COC(=O)C=CC(=O)O

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCC(=O)NC(CCO)COC(=O)/C=C\C(=O)O

InChI

InChI=1S/C26H45NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(29)27-23(20-21-28)22-33-26(32)19-18-25(30)31/h9-10,18-19,23,28H,2-8,11-17,20-22H2,1H3,(H,27,29)(H,30,31)/b10-9-,19-18-