(E)-3-[[4-(furan-2-ylcarbonylamino)-3-oxidanyl-phenyl]carbamoyl]nonadec-5-enoic acid

Systemtic Name: (E)-3-[[4-(furan-2-ylcarbonylamino)-3-oxidanyl-phenyl]carbamoyl]nonadec-5-enoic acid Openeye Name: (E)-3-[[4-(furan-2-carbonylamino)-3-hydroxy-phenyl]carbamoyl]nonadec-5-enoic acid CAS Name: (E)-3-[[4-[[2-furanyl(oxo)methyl]amino]-3-hydroxyanilino]-oxomethyl]-5-nonadecenoic acid IUPAC Name: (E)-3-[[4-(furan-2-carbonylamino)-3-hydroxyphenyl]carbamoyl]nonadec-5-enoic acid Traditional Name: (E)-3-[[4-(2-furoylamino)-3-hydroxy-phenyl]carbamoyl]nonadec-5-enoic acid Formula: C31H44N2O6 MolecularWeight: 540.69086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CCC(CC(=O)O)C(=O)NC1=CC(=C(C=C1)NC(=O)C2=CC=CO2)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/CC(CC(=O)O)C(=O)NC1=CC(=C(C=C1)NC(=O)C2=CC=CO2)O

InChI

InChI=1S/C31H44N2O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24(22-29(35)36)30(37)32-25-19-20-26(27(34)23-25)33-31(38)28-18-16-21-39-28/h14-16,18-21,23-24,34H,2-13,17,22H2,1H3,(H,32,37)(H,33,38)(H,35,36)/b15-14+