[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-phenethyl-azanium

Systemtic Name: [5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-phenethyl-azanium Openeye Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-phenethyl-ammonium CAS Name: [5-(3-chloro-2-methylphenyl)-2-furanyl]methyl-phenethylammonium IUPAC Name: [5-(3-chloro-2-methylphenyl)furan-2-yl]methyl-phenethylazanium Traditional Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-phenethyl-ammonium Formula: C20H21ClNO+ MolecularWeight: 326.83984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C20H20ClNO/c1-15-18(8-5-9-19(15)21)20-11-10-17(23-20)14-22-13-12-16-6-3-2-4-7-16/h2-11,22H,12-14H2,1H3/p+1