[3-(4-azanylphenoxy)-2-oxidanyl-propyl]-bis(3-formamidopropyl)-methyl-azanium chloride

Systemtic Name: [3-(4-azanylphenoxy)-2-oxidanyl-propyl]-bis(3-formamidopropyl)-methyl-azanium chloride Openeye Name: [3-(4-aminophenoxy)-2-hydroxy-propyl]-bis(3-formamidopropyl)-methyl-ammonium chloride CAS Name: [3-(4-aminophenoxy)-2-hydroxypropyl]-bis(3-formamidopropyl)-methylammonium chloride IUPAC Name: [3-(4-aminophenoxy)-2-hydroxypropyl]-bis(3-formamidopropyl)-methylazanium chloride Traditional Name: [3-(4-aminophenoxy)-2-hydroxy-propyl]-bis(3-formamidopropyl)-methyl-ammonium chloride Formula: C18H31ClN4O4 MolecularWeight: 402.91614

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCCNC=O)(CCCNC=O)CC(COC1=CC=C(C=C1)N)O.[Cl-]

Isomeric SMILES

C[N+](CCCNC=O)(CCCNC=O)CC(COC1=CC=C(C=C1)N)O.[Cl-]

InChI

InChI=1S/C18H30N4O4.ClH/c1-22(10-2-8-20-14-23,11-3-9-21-15-24)12-17(25)13-26-18-6-4-16(19)5-7-18;/h4-7,14-15,17,25H,2-3,8-13,19H2,1H3,(H-,20,21,23,24);1H