2-[2,5-bis(azanyl)phenoxy]ethyl-diethyl-methyl-azanium hydrate

Systemtic Name: 2-[2,5-bis(azanyl)phenoxy]ethyl-diethyl-methyl-azanium hydrate Openeye Name: 2-(2,5-diaminophenoxy)ethyl-diethyl-methyl-ammonium hydrate CAS Name: 2-(2,5-diaminophenoxy)ethyl-diethyl-methylammonium hydrate IUPAC Name: 2-(2,5-diaminophenoxy)ethyl-diethyl-methylazanium hydrate Traditional Name: 2-(2,5-diaminophenoxy)ethyl-diethyl-methyl-ammonium hydrate Formula: C13H26N3O2+ MolecularWeight: 256.36444

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC1=C(C=CC(=C1)N)N.O

Isomeric SMILES

CC[N+](C)(CC)CCOC1=C(C=CC(=C1)N)N.O

InChI

InChI=1S/C13H24N3O.H2O/c1-4-16(3,5-2)8-9-17-13-10-11(14)6-7-12(13)15;/h6-7,10H,4-5,8-9,14-15H2,1-3H3;1H2/q+1;