5-[2-[3-(5-azanyl-1,3-dihexadecoxy-hexan-3-yl)hexadecoxy]ethyl]-4-hexadecoxy-4-(2-hexadecoxyethyl)octadecan-2-amine

Systemtic Name: 5-[2-[3-(5-azanyl-1,3-dihexadecoxy-hexan-3-yl)hexadecoxy]ethyl]-4-hexadecoxy-4-(2-hexadecoxyethyl)octadecan-2-amine Openeye Name: 5-[2-[3-[3-amino-1-hexadecoxy-1-(2-hexadecoxyethyl)butyl]hexadecoxy]ethyl]-4-hexadecoxy-4-(2-hexadecoxyethyl)octadecan-2-amine CAS Name: 5-[2-[3-(5-amino-1,3-dihexadecoxyhexan-3-yl)hexadecoxy]ethyl]-4-hexadecoxy-4-(2-hexadecoxyethyl)-2-octadecanamine IUPAC Name: 5-[2-[3-(5-amino-1,3-dihexadecoxyhexan-3-yl)hexadecoxy]ethyl]-4-hexadecoxy-4-(2-hexadecoxyethyl)octadecan-2-amine Traditional Name: [4-[2-[3-[3-amino-1-cetyloxy-1-(2-cetyloxyethyl)butyl]hexadecoxy]ethyl]-3-cetyloxy-3-(2-cetyloxyethyl)-1-methyl-heptadecyl]amine Formula: C108H220N2O5 MolecularWeight: 1626.9128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCC(CC(C)N)(C(CCCCCCCCCCCCC)CCOCCC(CCCCCCCCCCCCC)C(CCOCCCCCCCCCCCCCCCC)(CC(C)N)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCC(CC(C)N)(C(CCCCCCCCCCCCC)CCOCCC(CCCCCCCCCCCCC)C(CCOCCCCCCCCCCCCCCCC)(CC(C)N)OCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C108H220N2O5/c1-9-15-21-27-33-39-45-49-53-59-65-71-77-83-93-111-99-91-107(101-103(7)109,114-95-85-79-73-67-61-55-51-47-41-35-29-23-17-11-3)105(87-81-75-69-63-57-43-37-31-25-19-13-5)89-97-113-98-90-106(88-82-76-70-64-58-44-38-32-26-20-14-6)108(102-104(8)110,115-96-86-80-74-68-62-56-52-48-42-36-30-24-18-12-4)92-100-112-94-84-78-72-66-60-54-50-46-40-34-28-22-16-10-2/h103-106H,9-102,109-110H2,1-8H3