methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoylamino]methyl]-2-methoxy-benzoate

Systemtic Name: methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoylamino]methyl]-2-methoxy-benzoate Openeye Name: methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoylamino]methyl]-2-methoxy-benzoate CAS Name: 5-[[[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-oxomethyl]amino]methyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoylamino]methyl]-2-methoxybenzoate Traditional Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoylamino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NCCC2=CC3=C(C=C2)OCCO3)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NCCC2=CC3=C(C=C2)OCCO3)C(=O)OC

InChI

InChI=1S/C21H24N2O6/c1-26-17-5-4-15(11-16(17)20(24)27-2)13-23-21(25)22-8-7-14-3-6-18-19(12-14)29-10-9-28-18/h3-6,11-12H,7-10,13H2,1-2H3,(H2,22,23,25)