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

Systemtic Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-3-(4-methylphenyl)propanoate Openeye Name: isopropyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(p-tolyl)propanoate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-3-(4-methylphenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-3-(4-methylphenyl)propanoate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)-3-(p-tolyl)propionic acid isopropyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO5/c1-14(2)28-21(24)13-18(16-6-4-15(3)5-7-16)23-22(25)17-8-9-19-20(12-17)27-11-10-26-19/h4-9,12,14,18H,10-11,13H2,1-3H3,(H,23,25)