[2-chloranyl-6-(4-propan-2-ylphenoxy)phenyl]methylazanium

Systemtic Name: [2-chloranyl-6-(4-propan-2-ylphenoxy)phenyl]methylazanium Openeye Name: [2-chloro-6-(4-isopropylphenoxy)phenyl]methylammonium CAS Name: [2-chloro-6-(4-propan-2-ylphenoxy)phenyl]methylammonium IUPAC Name: [2-chloro-6-(4-propan-2-ylphenoxy)phenyl]methylazanium Traditional Name: [2-chloro-6-(4-isopropylphenoxy)benzyl]ammonium Formula: C16H19ClNO+ MolecularWeight: 276.78116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)C[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)C[NH3+]

InChI

InChI=1S/C16H18ClNO/c1-11(2)12-6-8-13(9-7-12)19-16-5-3-4-15(17)14(16)10-18/h3-9,11H,10,18H2,1-2H3/p+1