[5-(4-bromanyl-2-methyl-phenyl)furan-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: [5-(4-bromanyl-2-methyl-phenyl)furan-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [5-(4-bromo-2-methyl-phenyl)-2-furyl]methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [5-(4-bromo-2-methylphenyl)-2-furanyl]methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [5-(4-bromo-2-methylphenyl)furan-2-yl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [5-(4-bromo-2-methyl-phenyl)-2-furyl]methyl-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C18H25BrN2O2+2 MolecularWeight: 381.3073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)C2=CC=C(O2)C[NH2+]CC[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)C2=CC=C(O2)C[NH2+]CC[NH+]3CCOCC3

InChI

InChI=1S/C18H23BrN2O2/c1-14-12-15(19)2-4-17(14)18-5-3-16(23-18)13-20-6-7-21-8-10-22-11-9-21/h2-5,12,20H,6-11,13H2,1H3/p+2