(3-bromanyl-4-phenylmethoxy-phenyl)methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: (3-bromanyl-4-phenylmethoxy-phenyl)methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: (4-benzyloxy-3-bromo-phenyl)methyl-(3-isopropoxypropyl)ammonium CAS Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (3-bromo-4-phenylmethoxyphenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: (4-benzoxy-3-bromo-benzyl)-(3-isopropoxypropyl)ammonium Formula: C20H27BrNO2+ MolecularWeight: 393.33788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26BrNO2/c1-16(2)23-12-6-11-22-14-18-9-10-20(19(21)13-18)24-15-17-7-4-3-5-8-17/h3-5,7-10,13,16,22H,6,11-12,14-15H2,1-2H3/p+1