[4-(2-azanyl-2-oxidanylidene-ethoxy)-2-bromanyl-5-ethoxy-phenyl]methyl-butyl-azanium

Systemtic Name: [4-(2-azanyl-2-oxidanylidene-ethoxy)-2-bromanyl-5-ethoxy-phenyl]methyl-butyl-azanium Openeye Name: [4-(2-amino-2-oxo-ethoxy)-2-bromo-5-ethoxy-phenyl]methyl-butyl-ammonium CAS Name: [4-(2-amino-2-oxoethoxy)-2-bromo-5-ethoxyphenyl]methyl-butylammonium IUPAC Name: [4-(2-amino-2-oxoethoxy)-2-bromo-5-ethoxyphenyl]methyl-butylazanium Traditional Name: [4-(2-amino-2-keto-ethoxy)-2-bromo-5-ethoxy-benzyl]-butyl-ammonium Formula: C15H24BrN2O3+ MolecularWeight: 360.26666

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=CC(=C(C=C1Br)OCC(=O)N)OCC

Isomeric SMILES

CCCC[NH2+]CC1=CC(=C(C=C1Br)OCC(=O)N)OCC

InChI

InChI=1S/C15H23BrN2O3/c1-3-5-6-18-9-11-7-13(20-4-2)14(8-12(11)16)21-10-15(17)19/h7-8,18H,3-6,9-10H2,1-2H3,(H2,17,19)/p+1