N-(2-azanylethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide

Systemtic Name: N-(2-azanylethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide Openeye Name: N-(2-aminoethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide CAS Name: N-(2-aminoethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide IUPAC Name: N-(2-aminoethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide Traditional Name: N-(2-aminoethyl)-3,4-bis[(Z)-octadec-9-enoxy]benzamide Formula: C45H80N2O3 MolecularWeight: 697.1283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC1=C(C=C(C=C1)C(=O)NCCN)OCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCOC1=C(C=C(C=C1)C(=O)NCCN)OCCCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C45H80N2O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-49-43-36-35-42(45(48)47-38-37-46)41-44(43)50-40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,35-36,41H,3-16,21-34,37-40,46H2,1-2H3,(H,47,48)/b19-17-,20-18-