(3-bromanyl-4-methoxy-phenyl)methyl-pentan-3-yl-azanium

Systemtic Name: (3-bromanyl-4-methoxy-phenyl)methyl-pentan-3-yl-azanium Openeye Name: (3-bromo-4-methoxy-phenyl)methyl-(1-ethylpropyl)ammonium CAS Name: (3-bromo-4-methoxyphenyl)methyl-pentan-3-ylammonium IUPAC Name: (3-bromo-4-methoxyphenyl)methyl-pentan-3-ylazanium Traditional Name: (3-bromo-4-methoxy-benzyl)-(1-ethylpropyl)ammonium Formula: C13H21BrNO+ MolecularWeight: 287.21594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CCC(CC)[NH2+]CC1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C13H20BrNO/c1-4-11(5-2)15-9-10-6-7-13(16-3)12(14)8-10/h6-8,11,15H,4-5,9H2,1-3H3/p+1