[4-butoxy-3,5-bis(chloranyl)phenyl]methyl-propyl-azanium

Systemtic Name: [4-butoxy-3,5-bis(chloranyl)phenyl]methyl-propyl-azanium Openeye Name: (4-butoxy-3,5-dichloro-phenyl)methyl-propyl-ammonium CAS Name: (4-butoxy-3,5-dichlorophenyl)methyl-propylammonium IUPAC Name: (4-butoxy-3,5-dichlorophenyl)methyl-propylazanium Traditional Name: (4-butoxy-3,5-dichloro-benzyl)-propyl-ammonium Formula: C14H22Cl2NO+ MolecularWeight: 291.23658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C[NH2+]CCC)Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C[NH2+]CCC)Cl

InChI

InChI=1S/C14H21Cl2NO/c1-3-5-7-18-14-12(15)8-11(9-13(14)16)10-17-6-4-2/h8-9,17H,3-7,10H2,1-2H3/p+1