2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(octadecanoylamino)ethyl]azanium

Systemtic Name: 2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(octadecanoylamino)ethyl]azanium Openeye Name: 2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(octadecanoylamino)ethyl]ammonium CAS Name: 2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(1-oxooctadecylamino)ethyl]ammonium IUPAC Name: 2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-[2-(octadecanoylamino)ethyl]azanium Traditional Name: 2-cyanoethyl-[2-(2-cyanoethylamino)ethyl]-ethyl-(2-stearamidoethyl)ammonium Formula: C30H58N5O+ MolecularWeight: 504.81442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNCCC#N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CCC#N)CCNCCC#N

InChI

InChI=1S/C30H57N5O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-30(36)34-26-29-35(4-2,27-20-23-32)28-25-33-24-19-22-31/h33H,3-21,24-29H2,1-2H3/p+1