[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [5-(3-chloro-2-methylphenyl)-2-furanyl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [5-(3-chloro-2-methylphenyl)furan-2-yl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-(3-imidazol-1-ylpropyl)ammonium Formula: C18H21ClN3O+ MolecularWeight: 330.83184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CCCN3C=CN=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CCCN3C=CN=C3

InChI

InChI=1S/C18H20ClN3O/c1-14-16(4-2-5-17(14)19)18-7-6-15(23-18)12-20-8-3-10-22-11-9-21-13-22/h2,4-7,9,11,13,20H,3,8,10,12H2,1H3/p+1