2-(4-phenylpiperazin-1-yl)carbonylpyridine-3-carboxylic acid

Systemtic Name: 2-(4-phenylpiperazin-1-yl)carbonylpyridine-3-carboxylic acid Openeye Name: 2-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxylic acid CAS Name: 2-[oxo-(4-phenyl-1-piperazinyl)methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(4-phenylpiperazine-1-carbonyl)pyridine-3-carboxylic acid Traditional Name: 2-(4-phenylpiperazine-1-carbonyl)nicotinic acid Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C17H17N3O3/c21-16(15-14(17(22)23)7-4-8-18-15)20-11-9-19(10-12-20)13-5-2-1-3-6-13/h1-8H,9-12H2,(H,22,23)