(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-(4-hydroxyphenyl)propanoate

Systemtic Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: (2R)-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2R)-2-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-3-(4-hydroxyphenyl)propanoate IUPAC Name: (2R)-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(4-hydroxyphenyl)propanoate Traditional Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-3-(4-hydroxyphenyl)propionate Formula: C18H16NO6- MolecularWeight: 342.32274

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)N[C@H](CC3=CC=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C18H17NO6/c20-13-4-1-11(2-5-13)9-14(18(22)23)19-17(21)12-3-6-15-16(10-12)25-8-7-24-15/h1-6,10,14,20H,7-9H2,(H,19,21)(H,22,23)/p-1/t14-/m1/s1