[2-bromanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-propyl-azanium

Systemtic Name: [2-bromanyl-5-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methyl-propyl-azanium Openeye Name: [4-(2-anilino-2-oxo-ethoxy)-2-bromo-5-methoxy-phenyl]methyl-propyl-ammonium CAS Name: [4-(2-anilino-2-oxoethoxy)-2-bromo-5-methoxyphenyl]methyl-propylammonium IUPAC Name: [4-(2-anilino-2-oxoethoxy)-2-bromo-5-methoxyphenyl]methyl-propylazanium Traditional Name: [4-(2-anilino-2-keto-ethoxy)-2-bromo-5-methoxy-benzyl]-propyl-ammonium Formula: C19H24BrN2O3+ MolecularWeight: 408.30946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC1=CC(=C(C=C1Br)OCC(=O)NC2=CC=CC=C2)OC

Isomeric SMILES

CCC[NH2+]CC1=CC(=C(C=C1Br)OCC(=O)NC2=CC=CC=C2)OC

InChI

InChI=1S/C19H23BrN2O3/c1-3-9-21-12-14-10-17(24-2)18(11-16(14)20)25-13-19(23)22-15-7-5-4-6-8-15/h4-8,10-11,21H,3,9,12-13H2,1-2H3,(H,22,23)/p+1