methyl 3-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)propanoate

Systemtic Name: methyl 3-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)propanoate Openeye Name: methyl 3-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)propanoate CAS Name: 3-(2-chlorophenyl)-3-[[(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)propanoate Traditional Name: 3-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoylamino)propionic acid methyl ester Formula: C20H21ClN2O5 MolecularWeight: 404.84414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C20H21ClN2O5/c1-26-19(24)10-16(14-6-2-3-7-15(14)21)23-20(25)22-11-13-12-27-17-8-4-5-9-18(17)28-13/h2-9,13,16H,10-12H2,1H3,(H2,22,23,25)