[2-chloranyl-6-(3-methyl-4-propan-2-yl-phenoxy)phenyl]methylazanium

Systemtic Name: [2-chloranyl-6-(3-methyl-4-propan-2-yl-phenoxy)phenyl]methylazanium Openeye Name: [2-chloro-6-(4-isopropyl-3-methyl-phenoxy)phenyl]methylammonium CAS Name: [2-chloro-6-(3-methyl-4-propan-2-ylphenoxy)phenyl]methylammonium IUPAC Name: [2-chloro-6-(3-methyl-4-propan-2-ylphenoxy)phenyl]methylazanium Traditional Name: [2-chloro-6-(4-isopropyl-3-methyl-phenoxy)benzyl]ammonium Formula: C17H21ClNO+ MolecularWeight: 290.80774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=CC=C2)Cl)C[NH3+])C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=CC=C2)Cl)C[NH3+])C(C)C

InChI

InChI=1S/C17H20ClNO/c1-11(2)14-8-7-13(9-12(14)3)20-17-6-4-5-16(18)15(17)10-19/h4-9,11H,10,19H2,1-3H3/p+1