(4-butoxy-3-chloranyl-5-methoxy-phenyl)methylazanium

Systemtic Name: (4-butoxy-3-chloranyl-5-methoxy-phenyl)methylazanium Openeye Name: (4-butoxy-3-chloro-5-methoxy-phenyl)methylammonium CAS Name: (4-butoxy-3-chloro-5-methoxyphenyl)methylammonium IUPAC Name: (4-butoxy-3-chloro-5-methoxyphenyl)methylazanium Traditional Name: (4-butoxy-3-chloro-5-methoxy-benzyl)ammonium Formula: C12H19ClNO2+ MolecularWeight: 244.73776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C[NH3+])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C[NH3+])OC

InChI

InChI=1S/C12H18ClNO2/c1-3-4-5-16-12-10(13)6-9(8-14)7-11(12)15-2/h6-7H,3-5,8,14H2,1-2H3/p+1