2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-(16-methylheptadecanoylamino)ethyl]azanium

Systemtic Name: 2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-(16-methylheptadecanoylamino)ethyl]azanium Openeye Name: 2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-(16-methylheptadecanoylamino)ethyl]ammonium CAS Name: 2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-[(16-methyl-1-oxoheptadecyl)amino]ethyl]ammonium IUPAC Name: 2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-(16-methylheptadecanoylamino)ethyl]azanium Traditional Name: 2-cyanoethyl-ethyl-(2-hydroxyethyl)-[2-(16-methylheptadecanoylamino)ethyl]ammonium Formula: C27H54N3O2+ MolecularWeight: 452.73656

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CCC#N)(CCNC(=O)CCCCCCCCCCCCCCC(C)C)CCO

Isomeric SMILES

CC[N+](CCC#N)(CCNC(=O)CCCCCCCCCCCCCCC(C)C)CCO

InChI

InChI=1S/C27H53N3O2/c1-4-30(24-25-31,22-17-20-28)23-21-29-27(32)19-16-14-12-10-8-6-5-7-9-11-13-15-18-26(2)3/h26,31H,4-19,21-25H2,1-3H3/p+1