ethyl 4-[5-[[[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]amino]methyl]furan-2-yl]benzoate

Systemtic Name: ethyl 4-[5-[[[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]amino]methyl]furan-2-yl]benzoate Openeye Name: ethyl 4-[5-[[[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]amino]methyl]-2-furyl]benzoate CAS Name: 4-[5-[[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]methyl]-2-furanyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-[[[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]amino]methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[[[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]amino]methyl]-2-furyl]benzoic acid ethyl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNC(C)C(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CN[C@H](C)[C@H](C3=CC=CC=C3)O

InChI

InChI=1S/C23H25NO4/c1-3-27-23(26)19-11-9-17(10-12-19)21-14-13-20(28-21)15-24-16(2)22(25)18-7-5-4-6-8-18/h4-14,16,22,24-25H,3,15H2,1-2H3/t16-,22-/m1/s1