2,4,6-tris[[(3,4-dihexadecoxyphenyl)amino]methylidene]cyclohexane-1,3,5-trione

Systemtic Name: 2,4,6-tris[[(3,4-dihexadecoxyphenyl)amino]methylidene]cyclohexane-1,3,5-trione Openeye Name: 2,4,6-tris[(3,4-dihexadecoxyanilino)methylene]cyclohexane-1,3,5-trione CAS Name: 2,4,6-tris[(3,4-dihexadecoxyanilino)methylidene]cyclohexane-1,3,5-trione IUPAC Name: 2,4,6-tris[(3,4-dihexadecoxyanilino)methylidene]cyclohexane-1,3,5-trione Traditional Name: 2,4,6-tris[(3,4-dicetyloxyanilino)methylene]cyclohexane-1,3,5-trione Formula: C123H213N3O9 MolecularWeight: 1878.02202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)NC=C2C(=O)C(=CNC3=CC(=C(C=C3)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC)C(=O)C(=CNC4=CC(=C(C=C4)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC)C2=O)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)NC=C2C(=O)C(=CNC3=CC(=C(C=C3)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC)C(=O)C(=CNC4=CC(=C(C=C4)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC)C2=O)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C123H213N3O9/c1-7-13-19-25-31-37-43-49-55-61-67-73-79-85-97-130-115-94-91-109(103-118(115)133-100-88-82-76-70-64-58-52-46-40-34-28-22-16-10-4)124-106-112-121(127)113(107-125-110-92-95-116(131-98-86-80-74-68-62-56-50-44-38-32-26-20-14-8-2)119(104-110)134-101-89-83-77-71-65-59-53-47-41-35-29-23-17-11-5)123(129)114(122(112)128)108-126-111-93-96-117(132-99-87-81-75-69-63-57-51-45-39-33-27-21-15-9-3)120(105-111)135-102-90-84-78-72-66-60-54-48-42-36-30-24-18-12-6/h91-96,103-108,124-126H,7-90,97-102H2,1-6H3