[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-cyclopropyl-azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-cyclopropyl-azanium Openeye Name: [3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl-cyclopropyl-ammonium CAS Name: [3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl-cyclopropylammonium IUPAC Name: [3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-cyclopropylazanium Traditional Name: [3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]-cyclopropyl-ammonium Formula: C17H20BrN2O2+ MolecularWeight: 364.2569

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]C2CC2)Br)OCC3=CN=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]C2CC2)Br)OCC3=CN=CC=C3

InChI

InChI=1S/C17H19BrN2O2/c1-21-16-8-13(10-20-14-4-5-14)7-15(18)17(16)22-11-12-3-2-6-19-9-12/h2-3,6-9,14,20H,4-5,10-11H2,1H3/p+1