4-[2-oxidanylidene-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-[2-oxidanylidene-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-[2-oxo-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-[2-oxo-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-[2-oxo-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-[2-keto-2-(1H-pyrazol-5-ylamino)ethyl]-4-phenyl-piperidine-1-carboxylic acid Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CC(=O)NC2=CC=NN2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1(CC(=O)NC2=CC=NN2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H20N4O3/c22-15(19-14-6-9-18-20-14)12-17(13-4-2-1-3-5-13)7-10-21(11-8-17)16(23)24/h1-6,9H,7-8,10-12H2,(H,23,24)(H2,18,19,20,22)