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

Systemtic Name: 1-adamantyl-[[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl]azanium Openeye Name: 1-adamantyl-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl]ammonium CAS Name: 1-adamantyl-[[5-(3-chloro-2-methylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methyl]azanium Traditional Name: 1-adamantyl-[[5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl]ammonium Formula: C22H27ClNO+ MolecularWeight: 356.90888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H26ClNO/c1-14-19(3-2-4-20(14)23)21-6-5-18(25-21)13-24-22-10-15-7-16(11-22)9-17(8-15)12-22/h2-6,15-17,24H,7-13H2,1H3/p+1