1-(3-methoxy-7-octadecyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole

Systemtic Name: 1-(3-methoxy-7-octadecyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole Openeye Name: 1-(3-methoxy-7-octadecyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole CAS Name: 1-(3-methoxy-7-octadecyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole IUPAC Name: 1-(3-methoxy-7-octadecyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole Traditional Name: 1-(3-methoxy-7-stearyl-5,6-dihydrobenzo[c]xanthen-7-yl)benzotriazole Formula: C42H55N3O2 MolecularWeight: 633.905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1(C2=C(C3=C(CC2)C=C(C=C3)OC)OC4=CC=CC=C41)N5C6=CC=CC=C6N=N5

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1(C2=C(C3=C(CC2)C=C(C=C3)OC)OC4=CC=CC=C41)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C42H55N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-31-42(45-39-25-20-19-24-38(39)43-44-45)36-23-18-21-26-40(36)47-41-35-29-28-34(46-2)32-33(35)27-30-37(41)42/h18-21,23-26,28-29,32H,3-17,22,27,30-31H2,1-2H3