(4-methoxyphenyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: (4-methoxyphenyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: (4-methoxyphenyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-oxoethyl]-1-piperazinecarboxylic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-2-keto-ethyl]piperazine-1-carboxylic acid (4-methoxyphenyl) ester Formula: C23H27N3O6 MolecularWeight: 441.47698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O6/c1-29-18-3-5-19(6-4-18)32-23(28)26-9-8-24-17(15-26)13-22(27)25-14-16-2-7-20-21(12-16)31-11-10-30-20/h2-7,12,17,24H,8-11,13-15H2,1H3,(H,25,27)