N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]hexadecanamide

Systemtic Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-dien-1-yl]hexadecanamide Openeye Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-dien-1-yl]hexadecanamide CAS Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienyl]hexadecanamide IUPAC Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-dien-1-yl]hexadecanamide Traditional Name: N-[(4E)-4-(3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-dien-1-yl]palmitamide Formula: C29H40N2O3 MolecularWeight: 464.6395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC1=CC(=O)C(=C2NC3=CC=CC=C3O2)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC1=CC(=O)/C(=C/2\NC3=CC=CC=C3O2)/C=C1

InChI

InChI=1S/C29H40N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-28(33)30-23-20-21-24(26(32)22-23)29-31-25-17-15-16-18-27(25)34-29/h15-18,20-22,31H,2-14,19H2,1H3,(H,30,33)/b29-24+