[5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium

Systemtic Name: [5-(3-chloranyl-2-methyl-phenyl)furan-2-yl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium CAS Name: [5-(3-chloro-2-methylphenyl)-2-furanyl]methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]ammonium IUPAC Name: [5-(3-chloro-2-methylphenyl)furan-2-yl]methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]azanium Traditional Name: [5-(3-chloro-2-methyl-phenyl)-2-furyl]methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium Formula: C21H23ClNO2+ MolecularWeight: 356.86582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2=CC=C(O2)C[NH2+][C@H](C)[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C21H22ClNO2/c1-14-18(9-6-10-19(14)22)20-12-11-17(25-20)13-23-15(2)21(24)16-7-4-3-5-8-16/h3-12,15,21,23-24H,13H2,1-2H3/p+1/t15-,21-/m1/s1