(3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl-ethyl-azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-propoxy-phenyl)methyl-ethyl-azanium Openeye Name: (3-bromo-5-methoxy-4-propoxy-phenyl)methyl-ethyl-ammonium CAS Name: (3-bromo-5-methoxy-4-propoxyphenyl)methyl-ethylammonium IUPAC Name: (3-bromo-5-methoxy-4-propoxyphenyl)methyl-ethylazanium Traditional Name: (3-bromo-5-methoxy-4-propoxy-benzyl)-ethyl-ammonium Formula: C13H21BrNO2+ MolecularWeight: 303.21534

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C[NH2+]CC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C[NH2+]CC)OC

InChI

InChI=1S/C13H20BrNO2/c1-4-6-17-13-11(14)7-10(9-15-5-2)8-12(13)16-3/h7-8,15H,4-6,9H2,1-3H3/p+1