1-(pyridin-4-ylcarbonylamino)cycloheptane-1-carboxylic acid

Systemtic Name: 1-(pyridin-4-ylcarbonylamino)cycloheptane-1-carboxylic acid Openeye Name: 1-(pyridine-4-carbonylamino)cycloheptanecarboxylic acid CAS Name: 1-[[oxo(pyridin-4-yl)methyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-(pyridine-4-carbonylamino)cycloheptane-1-carboxylic acid Traditional Name: 1-isonicotinamidocycloheptanecarboxylic acid Formula: C14H18N2O3 MolecularWeight: 262.30432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC=NC=C2

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C14H18N2O3/c17-12(11-5-9-15-10-6-11)16-14(13(18)19)7-3-1-2-4-8-14/h5-6,9-10H,1-4,7-8H2,(H,16,17)(H,18,19)