4-[bis[4-(dioctadecylamino)phenyl]methyl]-N,N-dioctadecyl-aniline

Systemtic Name: 4-[bis[4-(dioctadecylamino)phenyl]methyl]-N,N-dioctadecyl-aniline Openeye Name: 4-[bis[4-(dioctadecylamino)phenyl]methyl]-N,N-dioctadecyl-aniline CAS Name: 4-[bis[4-(dioctadecylamino)phenyl]methyl]-N,N-dioctadecylaniline IUPAC Name: 4-[bis[4-(dioctadecylamino)phenyl]methyl]-N,N-dioctadecylaniline Traditional Name: [4-[bis[4-(distearylamino)phenyl]methyl]phenyl]-distearyl-amine Formula: C127H235N3 MolecularWeight: 1804.2449

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)C3=CC=C(C=C3)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)C3=CC=C(C=C3)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C127H235N3/c1-7-13-19-25-31-37-43-49-55-61-67-73-79-85-91-97-115-128(116-98-92-86-80-74-68-62-56-50-44-38-32-26-20-14-8-2)124-109-103-121(104-110-124)127(122-105-111-125(112-106-122)129(117-99-93-87-81-75-69-63-57-51-45-39-33-27-21-15-9-3)118-100-94-88-82-76-70-64-58-52-46-40-34-28-22-16-10-4)123-107-113-126(114-108-123)130(119-101-95-89-83-77-71-65-59-53-47-41-35-29-23-17-11-5)120-102-96-90-84-78-72-66-60-54-48-42-36-30-24-18-12-6/h103-114,127H,7-102,115-120H2,1-6H3