[3-bromanyl-4-(cyanomethoxy)-5-methoxy-phenyl]methyl-cyclooctyl-azanium

Systemtic Name: [3-bromanyl-4-(cyanomethoxy)-5-methoxy-phenyl]methyl-cyclooctyl-azanium Openeye Name: [3-bromo-4-(cyanomethoxy)-5-methoxy-phenyl]methyl-cyclooctyl-ammonium CAS Name: [3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methyl-cyclooctylammonium IUPAC Name: [3-bromo-4-(cyanomethoxy)-5-methoxyphenyl]methyl-cyclooctylazanium Traditional Name: [3-bromo-4-(cyanomethoxy)-5-methoxy-benzyl]-cyclooctyl-ammonium Formula: C18H26BrN2O2+ MolecularWeight: 382.31524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCCCC2)Br)OCC#N

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CCCCCCC2)Br)OCC#N

InChI

InChI=1S/C18H25BrN2O2/c1-22-17-12-14(11-16(19)18(17)23-10-9-20)13-21-15-7-5-3-2-4-6-8-15/h11-12,15,21H,2-8,10,13H2,1H3/p+1