2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium

Systemtic Name: 2-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]ethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]ethyl]ammonium CAS Name: 2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]ethyl]azanium Traditional Name: benzyl-[2-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]ethyl]ammonium Formula: C21H30NO2+ MolecularWeight: 328.4684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCOCC[NH2+]CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCOCC[NH2+]CC2=CC=CC=C2)C(C)C

InChI

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