N-[3-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]propyl-dodecanoyl-amino]butyl]dodecanamide tetrahydrochloride

Systemtic Name: N-[3-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]propyl-dodecanoyl-amino]butyl]dodecanamide tetrahydrochloride Openeye Name: N-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl-dodecanoyl-amino]butyl]dodecanamide tetrahydrochloride CAS Name: N-[3-[[(2S)-2,6-diamino-1-oxohexyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-diamino-1-oxohexyl]amino]propyl-(1-oxododecyl)amino]butyl]dodecanamide tetrahydrochloride IUPAC Name: N-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl-dodecanoylamino]butyl]dodecanamide tetrahydrochloride Traditional Name: N-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl]-N-[4-[3-[[(2S)-2,6-diaminohexanoyl]amino]propyl-lauroyl-amino]butyl]lauramide tetrahydrochloride Formula: C46H98Cl4N8O4 MolecularWeight: 969.13352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N(CCCCN(CCCNC(=O)C(CCCCN)N)C(=O)CCCCCCCCCCC)CCCNC(=O)C(CCCCN)N.Cl.Cl.Cl.Cl

Isomeric SMILES

CCCCCCCCCCCC(=O)N(CCCCN(CCCNC(=O)[C@H](CCCCN)N)C(=O)CCCCCCCCCCC)CCCNC(=O)[C@H](CCCCN)N.Cl.Cl.Cl.Cl

InChI

InChI=1S/C46H94N8O4.4ClH/c1-3-5-7-9-11-13-15-17-19-31-43(55)53(39-27-35-51-45(57)41(49)29-21-23-33-47)37-25-26-38-54(40-28-36-52-46(58)42(50)30-22-24-34-48)44(56)32-20-18-16-14-12-10-8-6-4-2;;;;/h41-42H,3-40,47-50H2,1-2H3,(H,51,57)(H,52,58);4*1H/t41-,42-;;;;/m0..../s1