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

Systemtic Name: methyl 3-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: methyl 3-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoethyl]-1-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 3-[2-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-2-keto-ethyl]piperazine-1-carboxylic acid methyl ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCNC(C1)CC(=O)NCC2COC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)N1CCNC(C1)CC(=O)NCC2COC3=CC=CC=C3O2

InChI

InChI=1S/C17H23N3O5/c1-23-17(22)20-7-6-18-12(10-20)8-16(21)19-9-13-11-24-14-4-2-3-5-15(14)25-13/h2-5,12-13,18H,6-11H2,1H3,(H,19,21)