1-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(cycloheptylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-(cycloheptylamino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(cycloheptylamino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(cycloheptylamino)-2-keto-ethyl]pyrazole-4-carboxylic acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1CCCC(CC1)NC(=O)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C13H19N3O3/c17-12(15-11-5-3-1-2-4-6-11)9-16-8-10(7-14-16)13(18)19/h7-8,11H,1-6,9H2,(H,15,17)(H,18,19)