1-[3-(cycloheptylamino)-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-(cycloheptylamino)-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-(cycloheptylamino)-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-(cycloheptylamino)-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-(cycloheptylamino)-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-(cycloheptylamino)-3-keto-propyl]pyrazole-4-carboxylic acid Formula: C14H21N3O3 MolecularWeight: 279.33484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c18-13(16-12-5-3-1-2-4-6-12)7-8-17-10-11(9-15-17)14(19)20/h9-10,12H,1-8H2,(H,16,18)(H,19,20)