methyl 4-[(1,3-benzodioxol-5-ylmethylcarbamoylamino)methyl]benzoate

Systemtic Name: methyl 4-[(1,3-benzodioxol-5-ylmethylcarbamoylamino)methyl]benzoate Openeye Name: methyl 4-[(1,3-benzodioxol-5-ylmethylcarbamoylamino)methyl]benzoate CAS Name: 4-[[[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1,3-benzodioxol-5-ylmethylcarbamoylamino)methyl]benzoate Traditional Name: 4-[(piperonylcarbamoylamino)methyl]benzoic acid methyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O5/c1-23-17(21)14-5-2-12(3-6-14)9-19-18(22)20-10-13-4-7-15-16(8-13)25-11-24-15/h2-8H,9-11H2,1H3,(H2,19,20,22)