3-(3-azaniumylpropylamino)propyl-[3-[4-(2-methylpropyl)phenoxy]propyl]azanium

Systemtic Name: 3-(3-azaniumylpropylamino)propyl-[3-[4-(2-methylpropyl)phenoxy]propyl]azanium Openeye Name: 3-(3-azaniumylpropylamino)propyl-[3-(4-isobutylphenoxy)propyl]ammonium CAS Name: 3-(3-ammoniopropylamino)propyl-[3-[4-(2-methylpropyl)phenoxy]propyl]ammonium IUPAC Name: 3-(3-azaniumylpropylamino)propyl-[3-[4-(2-methylpropyl)phenoxy]propyl]azanium Traditional Name: 3-(3-ammoniopropylamino)propyl-[3-(4-isobutylphenoxy)propyl]ammonium Formula: C19H37N3O+2 MolecularWeight: 323.51658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)OCCC[NH2+]CCCNCCC[NH3+]

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)OCCC[NH2+]CCCNCCC[NH3+]

InChI

InChI=1S/C19H35N3O/c1-17(2)16-18-6-8-19(9-7-18)23-15-5-14-22-13-4-12-21-11-3-10-20/h6-9,17,21-22H,3-5,10-16,20H2,1-2H3/p+2