(E)-docos-13-enoic acid; urea

Systemtic Name: (E)-docos-13-enoic acid; urea Openeye Name: (E)-docos-13-enoic acid; urea CAS Name: (E)-13-docosenoic acid; urea IUPAC Name: (E)-docos-13-enoic acid; urea Traditional Name: (E)-docos-13-enoic acid; urea Formula: C23H46N2O3 MolecularWeight: 398.62294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCC(=O)O.C(=O)(N)N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCC(=O)O.C(=O)(N)N

InChI

InChI=1S/C22H42O2.CH4N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24;2-1(3)4/h9-10H,2-8,11-21H2,1H3,(H,23,24);(H4,2,3,4)/b10-9+;