[3-bromanyl-5-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methyl-butyl-azanium

Systemtic Name: [3-bromanyl-5-methoxy-4-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]methyl-butyl-azanium Openeye Name: [3-bromo-5-methoxy-4-(2-morpholino-2-oxo-ethoxy)phenyl]methyl-butyl-ammonium CAS Name: [3-bromo-5-methoxy-4-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]methyl-butylammonium IUPAC Name: [3-bromo-5-methoxy-4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]methyl-butylazanium Traditional Name: [3-bromo-4-(2-keto-2-morpholino-ethoxy)-5-methoxy-benzyl]-butyl-ammonium Formula: C18H28BrN2O4+ MolecularWeight: 416.32992

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC(=O)N2CCOCC2)OC

Isomeric SMILES

CCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC(=O)N2CCOCC2)OC

InChI

InChI=1S/C18H27BrN2O4/c1-3-4-5-20-12-14-10-15(19)18(16(11-14)23-2)25-13-17(22)21-6-8-24-9-7-21/h10-11,20H,3-9,12-13H2,1-2H3/p+1