(4-methoxyphenyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)piperazine-1-carboxylate CAS Name: 3-[(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-oxomethyl]-1-piperazinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)piperazine-1-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylcarbamoyl)piperazine-1-carboxylic acid (4-methoxyphenyl) ester Formula: C22H25N3O6 MolecularWeight: 427.4504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)N2CCNC(C2)C(=O)NCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)N2CCNC(C2)C(=O)NCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H25N3O6/c1-28-16-3-5-17(6-4-16)31-22(27)25-9-8-23-18(14-25)21(26)24-13-15-2-7-19-20(12-15)30-11-10-29-19/h2-7,12,18,23H,8-11,13-14H2,1H3,(H,24,26)