methyl (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-[(2-hydroxyphenyl)amino]-2-phenyl-2-propan-2-yloxy-propanoate

Systemtic Name: methyl (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-[(2-hydroxyphenyl)amino]-2-phenyl-2-propan-2-yloxy-propanoate Openeye Name: methyl (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-(2-hydroxyanilino)-2-isopropoxy-2-phenyl-propanoate CAS Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-(2-hydroxyanilino)-2-phenyl-2-propan-2-yloxypropanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-(2-hydroxyanilino)-2-phenyl-2-propan-2-yloxypropanoate Traditional Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)-3-(2-hydroxyanilino)-2-isopropoxy-2-phenyl-propionic acid methyl ester Formula: C26H27NO6 MolecularWeight: 449.49568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C1=CC=CC=C1)(C(C2=CC3=C(C=C2)OCO3)NC4=CC=CC=C4O)C(=O)OC

Isomeric SMILES

CC(C)O[C@@](C1=CC=CC=C1)([C@H](C2=CC3=C(C=C2)OCO3)NC4=CC=CC=C4O)C(=O)OC

InChI

InChI=1S/C26H27NO6/c1-17(2)33-26(25(29)30-3,19-9-5-4-6-10-19)24(27-20-11-7-8-12-21(20)28)18-13-14-22-23(15-18)32-16-31-22/h4-15,17,24,27-28H,16H2,1-3H3/t24-,26-/m0/s1