2-[4-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]carbonyloxybutanedioic acid

Systemtic Name: 2-[4-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]carbonyloxybutanedioic acid Openeye Name: 2-[4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]oxybutanedioic acid CAS Name: 2-[oxo-[4-[[(4E)-pentadeca-4,14-dienyl]amino]phenyl]methoxy]butanedioic acid IUPAC Name: 2-[4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]oxybutanedioic acid Traditional Name: 2-[4-[[(4E)-pentadeca-4,14-dienyl]amino]benzoyl]oxysuccinic acid Formula: C26H37NO6 MolecularWeight: 459.57508

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCCCC=CCCCNC1=CC=C(C=C1)C(=O)OC(CC(=O)O)C(=O)O

Isomeric SMILES

C=CCCCCCCCC/C=C/CCCNC1=CC=C(C=C1)C(=O)OC(CC(=O)O)C(=O)O

InChI

InChI=1S/C26H37NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-27-22-17-15-21(16-18-22)26(32)33-23(25(30)31)20-24(28)29/h2,11-12,15-18,23,27H,1,3-10,13-14,19-20H2,(H,28,29)(H,30,31)/b12-11+