6-chloranyl-N4-tridecyl-tridecane-1,2,4-triamine; methanol

Systemtic Name: 6-chloranyl-N4-tridecyl-tridecane-1,2,4-triamine; methanol Openeye Name: 6-chloro-N4-tridecyl-tridecane-1,2,4-triamine; methanol CAS Name: 6-chloro-N4-tridecyltridecane-1,2,4-triamine; methanol IUPAC Name: 6-chloro-4-N-tridecyltridecane-1,2,4-triamine; methanol Traditional Name: [3-chloro-1-(2,3-diaminopropyl)decyl]-tridecyl-amine; methanol Formula: C27H60ClN3O MolecularWeight: 478.2378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCNC(CC(CCCCCCC)Cl)CC(CN)N.CO

Isomeric SMILES

CCCCCCCCCCCCCNC(CC(CCCCCCC)Cl)CC(CN)N.CO

InChI

InChI=1S/C26H56ClN3.CH4O/c1-3-5-7-9-10-11-12-13-14-16-18-20-30-26(22-25(29)23-28)21-24(27)19-17-15-8-6-4-2;1-2/h24-26,30H,3-23,28-29H2,1-2H3;2H,1H3