1-[5-chloranyl-1-(3-chlorophenyl)-6-oxidanylidene-pyridazin-4-yl]piperidine-4-carboxylic acid

Systemtic Name: 1-[5-chloranyl-1-(3-chlorophenyl)-6-oxidanylidene-pyridazin-4-yl]piperidine-4-carboxylic acid Openeye Name: 1-[5-chloro-1-(3-chlorophenyl)-6-oxo-pyridazin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-[5-chloro-1-(3-chlorophenyl)-6-oxo-4-pyridazinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[5-chloro-1-(3-chlorophenyl)-6-oxopyridazin-4-yl]piperidine-4-carboxylic acid Traditional Name: 1-[5-chloro-1-(3-chlorophenyl)-6-keto-pyridazin-4-yl]isonipecotic acid Formula: C16H15Cl2N3O3 MolecularWeight: 368.2146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C(=O)N(N=C2)C3=CC(=CC=C3)Cl)Cl

InChI

InChI=1S/C16H15Cl2N3O3/c17-11-2-1-3-12(8-11)21-15(22)14(18)13(9-19-21)20-6-4-10(5-7-20)16(23)24/h1-3,8-10H,4-7H2,(H,23,24)