ethyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C21H29N3O6/c1-2-28-21(27)24-10-7-16(8-11-24)23-19(25)4-3-9-22-20(26)15-5-6-17-18(14-15)30-13-12-29-17/h5-6,14,16H,2-4,7-13H2,1H3,(H,22,26)(H,23,25)