propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-phenyl-propanoate Openeye Name: isopropyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-phenyl-propanoate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-phenylpropanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-3-phenyl-propionic acid isopropyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H23NO5/c1-14(2)27-20(23)13-17(15-6-4-3-5-7-15)22-21(24)16-8-9-18-19(12-16)26-11-10-25-18/h3-9,12,14,17H,10-11,13H2,1-2H3,(H,22,24)