ethyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]amino]propanoate

Systemtic Name: ethyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-oxidanyl-ethyl]amino]propanoate Openeye Name: ethyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]amino]propanoate CAS Name: 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-hydroxyethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-hydroxyethyl]amino]propanoate Traditional Name: 3-[[2-(2,2-diphenyl-1,3-benzodioxol-5-yl)-2-hydroxy-ethyl]amino]propionic acid ethyl ester Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNCC(C1=CC2=C(C=C1)OC(O2)(C3=CC=CC=C3)C4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)CCNCC(C1=CC2=C(C=C1)OC(O2)(C3=CC=CC=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C26H27NO5/c1-2-30-25(29)15-16-27-18-22(28)19-13-14-23-24(17-19)32-26(31-23,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-14,17,22,27-28H,2,15-16,18H2,1H3