[5-bromanyl-2-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-propyl-azanium

Systemtic Name: [5-bromanyl-2-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-propyl-azanium Openeye Name: [2-(2-anilino-2-oxo-ethoxy)-5-bromo-phenyl]methyl-propyl-ammonium CAS Name: [2-(2-anilino-2-oxoethoxy)-5-bromophenyl]methyl-propylammonium IUPAC Name: [2-(2-anilino-2-oxoethoxy)-5-bromophenyl]methyl-propylazanium Traditional Name: [2-(2-anilino-2-keto-ethoxy)-5-bromo-benzyl]-propyl-ammonium Formula: C18H22BrN2O2+ MolecularWeight: 378.28348

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCC[NH2+]CC1=C(C=CC(=C1)Br)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H21BrN2O2/c1-2-10-20-12-14-11-15(19)8-9-17(14)23-13-18(22)21-16-6-4-3-5-7-16/h3-9,11,20H,2,10,12-13H2,1H3,(H,21,22)/p+1