N1-octadecylpropane-1,2-diamine; propane-1,2-diamine; prop-1-ene

Systemtic Name: N1-octadecylpropane-1,2-diamine; propane-1,2-diamine; prop-1-ene Openeye Name: N1-octadecylpropane-1,2-diamine; propane-1,2-diamine; prop-1-ene CAS Name: N1-octadecylpropane-1,2-diamine; propane-1,2-diamine; 1-propene IUPAC Name: 1-N-octadecylpropane-1,2-diamine; propane-1,2-diamine; prop-1-ene Traditional Name: (2-amino-1-methyl-ethyl)amine; 2-aminopropyl(stearyl)amine; prop-1-ene Formula: C30H68N4 MolecularWeight: 484.88772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNCC(C)N.CC=C.CC=C.CC(CN)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNCC(C)N.CC=C.CC=C.CC(CN)N

InChI

InChI=1S/C21H46N2.C3H10N2.2C3H6/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-20-21(2)22;1-3(5)2-4;2*1-3-2/h21,23H,3-20,22H2,1-2H3;3H,2,4-5H2,1H3;2*3H,1H2,2H3