1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]cyclohexanecarboxylic acid CAS Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]cyclohexanecarboxylic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H21NO5/c19-15(18-17(16(20)21)6-2-1-3-7-17)11-12-4-5-13-14(10-12)23-9-8-22-13/h4-5,10H,1-3,6-9,11H2,(H,18,19)(H,20,21)