(12-dodecylbenzo[a]xanthen-9-ylidene)-diethyl-azanium perchlorate

Systemtic Name: (12-dodecylbenzo[a]xanthen-9-ylidene)-diethyl-azanium perchlorate Openeye Name: (12-dodecylbenzo[a]xanthen-9-ylidene)-diethyl-ammonium perchlorate CAS Name: (12-dodecyl-9-benzo[a]xanthenylidene)-diethylammonium perchlorate IUPAC Name: (12-dodecylbenzo[a]xanthen-9-ylidene)-diethylazanium perchlorate Traditional Name: diethyl-(12-laurylbenzo[a]xanthen-9-ylidene)ammonium perchlorate Formula: C33H44ClNO5 MolecularWeight: 570.15916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C2C=CC(=[N+](CC)CC)C=C2OC3=C1C4=CC=CC=C4C=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CCCCCCCCCCCCC1=C2C=CC(=[N+](CC)CC)C=C2OC3=C1C4=CC=CC=C4C=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C33H44NO.ClHO4/c1-4-7-8-9-10-11-12-13-14-15-20-30-29-23-22-27(34(5-2)6-3)25-32(29)35-31-24-21-26-18-16-17-19-28(26)33(30)31;2-1(3,4)5/h16-19,21-25H,4-15,20H2,1-3H3;(H,2,3,4,5)/q+1;/p-1