1-[3-(1,2,3-triazol-1-yl)propanoylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[3-(1,2,3-triazol-1-yl)propanoylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[3-(triazol-1-yl)propanoylamino]cycloheptanecarboxylic acid CAS Name: 1-[[1-oxo-3-(1-triazolyl)propyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[3-(triazol-1-yl)propanoylamino]cycloheptane-1-carboxylic acid Traditional Name: 1-[3-(triazol-1-yl)propanoylamino]cycloheptanecarboxylic acid Formula: C13H20N4O3 MolecularWeight: 280.3229

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)CCN2C=CN=N2

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)CCN2C=CN=N2

InChI

InChI=1S/C13H20N4O3/c18-11(5-9-17-10-8-14-16-17)15-13(12(19)20)6-3-1-2-4-7-13/h8,10H,1-7,9H2,(H,15,18)(H,19,20)