[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-propan-2-yl-azanium

Systemtic Name: [3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]methyl-propan-2-yl-azanium Openeye Name: (4-benzyloxy-3,5-dibromo-phenyl)methyl-isopropyl-ammonium CAS Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-propan-2-ylammonium IUPAC Name: (3,5-dibromo-4-phenylmethoxyphenyl)methyl-propan-2-ylazanium Traditional Name: (4-benzoxy-3,5-dibromo-benzyl)-isopropyl-ammonium Formula: C17H20Br2NO+ MolecularWeight: 414.1548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C17H19Br2NO/c1-12(2)20-10-14-8-15(18)17(16(19)9-14)21-11-13-6-4-3-5-7-13/h3-9,12,20H,10-11H2,1-2H3/p+1