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

Systemtic Name: methyl (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-(4-hydroxyphenyl)propanoate Openeye Name: methyl (2S)-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-3-(4-hydroxyphenyl)propionic acid methyl ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H19NO6/c1-24-19(23)15(10-12-2-5-14(21)6-3-12)20-18(22)13-4-7-16-17(11-13)26-9-8-25-16/h2-7,11,15,21H,8-10H2,1H3,(H,20,22)/t15-/m0/s1