[2-[(E)-2-acridin-9-ylethenyl]-5-(diethylamino)phenyl] octadecanoate

Systemtic Name: [2-[(E)-2-acridin-9-ylethenyl]-5-(diethylamino)phenyl] octadecanoate Openeye Name: [2-[(E)-2-acridin-9-ylvinyl]-5-(diethylamino)phenyl] octadecanoate CAS Name: octadecanoic acid [2-[(E)-2-(9-acridinyl)ethenyl]-5-(diethylamino)phenyl] ester IUPAC Name: [2-[(E)-2-acridin-9-ylethenyl]-5-(diethylamino)phenyl] octadecanoate Traditional Name: stearic acid [2-[(E)-2-acridin-9-ylvinyl]-5-(diethylamino)phenyl] ester Formula: C43H58N2O2 MolecularWeight: 634.93282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C=CC(=C1)N(CC)CC)C=CC2=C3C=CC=CC3=NC4=CC=CC=C42

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=C(C=CC(=C1)N(CC)CC)/C=C/C2=C3C=CC=CC3=NC4=CC=CC=C42

InChI

InChI=1S/C43H58N2O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-29-43(46)47-42-34-36(45(5-2)6-3)32-30-35(42)31-33-37-38-25-21-23-27-40(38)44-41-28-24-22-26-39(37)41/h21-28,30-34H,4-20,29H2,1-3H3/b33-31+