[5-(4-methoxycarbonylphenyl)furan-2-yl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium

Systemtic Name: [5-(4-methoxycarbonylphenyl)furan-2-yl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: [(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]-[[5-(4-methoxycarbonylphenyl)-2-furyl]methyl]ammonium CAS Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[5-(4-methoxycarbonylphenyl)-2-furanyl]methyl]ammonium IUPAC Name: [(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]-[[5-(4-methoxycarbonylphenyl)furan-2-yl]methyl]azanium Traditional Name: [5-(4-carbomethoxyphenyl)-2-furyl]methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium Formula: C22H24NO4+ MolecularWeight: 366.43026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)O)[NH2+]CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)O)[NH2+]CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H23NO4/c1-15(21(24)17-6-4-3-5-7-17)23-14-19-12-13-20(27-19)16-8-10-18(11-9-16)22(25)26-2/h3-13,15,21,23-24H,14H2,1-2H3/p+1/t15-,21-/m1/s1