[3-ethoxy-4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methylazanium

Systemtic Name: [3-ethoxy-4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methylazanium Openeye Name: [3-ethoxy-4-[2-(2-isopropylphenoxy)ethoxy]phenyl]methylammonium CAS Name: [3-ethoxy-4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methylammonium IUPAC Name: [3-ethoxy-4-[2-(2-propan-2-ylphenoxy)ethoxy]phenyl]methylazanium Traditional Name: [3-ethoxy-4-[2-(2-isopropylphenoxy)ethoxy]benzyl]ammonium Formula: C20H28NO3+ MolecularWeight: 330.44122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH3+])OCCOC2=CC=CC=C2C(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH3+])OCCOC2=CC=CC=C2C(C)C

InChI

InChI=1S/C20H27NO3/c1-4-22-20-13-16(14-21)9-10-19(20)24-12-11-23-18-8-6-5-7-17(18)15(2)3/h5-10,13,15H,4,11-12,14,21H2,1-3H3/p+1