(2-chloranyl-5-ethoxy-4-propoxy-phenyl)methyl-phenethyl-azanium

Systemtic Name: (2-chloranyl-5-ethoxy-4-propoxy-phenyl)methyl-phenethyl-azanium Openeye Name: (2-chloro-5-ethoxy-4-propoxy-phenyl)methyl-phenethyl-ammonium CAS Name: (2-chloro-5-ethoxy-4-propoxyphenyl)methyl-phenethylammonium IUPAC Name: (2-chloro-5-ethoxy-4-propoxyphenyl)methyl-phenethylazanium Traditional Name: (2-chloro-5-ethoxy-4-propoxy-benzyl)-phenethyl-ammonium Formula: C20H27ClNO2+ MolecularWeight: 348.88688

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C(=C1)Cl)C[NH2+]CCC2=CC=CC=C2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C(=C1)Cl)C[NH2+]CCC2=CC=CC=C2)OCC

InChI

InChI=1S/C20H26ClNO2/c1-3-12-24-20-14-18(21)17(13-19(20)23-4-2)15-22-11-10-16-8-6-5-7-9-16/h5-9,13-14,22H,3-4,10-12,15H2,1-2H3/p+1