methyl 4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoylamino]methyl]benzoate Openeye Name: methyl 4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoylamino]methyl]benzoate CAS Name: 4-[[[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylamino]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoylamino]methyl]benzoate Traditional Name: 4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methylcarbamoylamino]methyl]benzoic acid methyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NC[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C19H20N2O5/c1-24-18(22)14-8-6-13(7-9-14)10-20-19(23)21-11-15-12-25-16-4-2-3-5-17(16)26-15/h2-9,15H,10-12H2,1H3,(H2,20,21,23)/t15-/m0/s1