diethyl (2E,11E)-7-[[2-(hydroxymethyl)phenyl]carbonylamino]trideca-2,11-dienedioate

Systemtic Name: diethyl (2E,11E)-7-[[2-(hydroxymethyl)phenyl]carbonylamino]trideca-2,11-dienedioate Openeye Name: diethyl (2E,11E)-7-[[2-(hydroxymethyl)benzoyl]amino]trideca-2,11-dienedioate CAS Name: (2E,11E)-7-[[[2-(hydroxymethyl)phenyl]-oxomethyl]amino]trideca-2,11-dienedioic acid diethyl ester IUPAC Name: diethyl (2E,11E)-7-[[2-(hydroxymethyl)benzoyl]amino]trideca-2,11-dienedioate Traditional Name: (2E,11E)-7-[(2-methylolbenzoyl)amino]trideca-2,11-dienedioic acid diethyl ester Formula: C25H35NO6 MolecularWeight: 445.5485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCCC(CCCC=CC(=O)OCC)NC(=O)C1=CC=CC=C1CO

Isomeric SMILES

CCOC(=O)/C=C/CCCC(NC(=O)C1=CC=CC=C1CO)CCC/C=C/C(=O)OCC

InChI

InChI=1S/C25H35NO6/c1-3-31-23(28)17-9-5-7-14-21(15-8-6-10-18-24(29)32-4-2)26-25(30)22-16-12-11-13-20(22)19-27/h9-13,16-18,21,27H,3-8,14-15,19H2,1-2H3,(H,26,30)/b17-9+,18-10+