3-methoxypropyl-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]azanium

Systemtic Name: 3-methoxypropyl-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]azanium Openeye Name: 3-methoxypropyl-[2-[4-(1-methyl-1-phenyl-ethyl)phenoxy]ethyl]ammonium CAS Name: 3-methoxypropyl-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]ammonium IUPAC Name: 3-methoxypropyl-[2-[4-(2-phenylpropan-2-yl)phenoxy]ethyl]azanium Traditional Name: 2-(4-cumylphenoxy)ethyl-(3-methoxypropyl)ammonium Formula: C21H30NO2+ MolecularWeight: 328.4684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC[NH2+]CCCOC

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC[NH2+]CCCOC

InChI

InChI=1S/C21H29NO2/c1-21(2,18-8-5-4-6-9-18)19-10-12-20(13-11-19)24-17-15-22-14-7-16-23-3/h4-6,8-13,22H,7,14-17H2,1-3H3/p+1