(2-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methyl-cyclopentyl-azanium

Systemtic Name: (2-bromanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methyl-cyclopentyl-azanium Openeye Name: (2-bromo-5-methoxy-4-prop-2-ynoxy-phenyl)methyl-cyclopentyl-ammonium CAS Name: (2-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methyl-cyclopentylammonium IUPAC Name: (2-bromo-5-methoxy-4-prop-2-ynoxyphenyl)methyl-cyclopentylazanium Traditional Name: (2-bromo-5-methoxy-4-propargyloxy-benzyl)-cyclopentyl-ammonium Formula: C16H21BrNO2+ MolecularWeight: 339.24744

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C[NH2+]C2CCCC2)Br)OCC#C

Isomeric SMILES

COC1=C(C=C(C(=C1)C[NH2+]C2CCCC2)Br)OCC#C

InChI

InChI=1S/C16H20BrNO2/c1-3-8-20-16-10-14(17)12(9-15(16)19-2)11-18-13-6-4-5-7-13/h1,9-10,13,18H,4-8,11H2,2H3/p+1