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

Systemtic Name: [5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: [5-(4-ethoxycarbonylphenyl)-2-furyl]methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium CAS Name: [5-(4-ethoxycarbonylphenyl)-2-furanyl]methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]ammonium IUPAC Name: [5-(4-ethoxycarbonylphenyl)furan-2-yl]methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]azanium Traditional Name: [5-(4-carbethoxyphenyl)-2-furyl]methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium Formula: C23H26NO4+ MolecularWeight: 380.45684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+]C(C)C(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C[NH2+][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/p+1/t16-,22-/m1/s1