4-oxidanylidene-6-phenyl-1-(4-piperazin-1-ylphenyl)pyridine-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-6-phenyl-1-(4-piperazin-1-ylphenyl)pyridine-3-carboxylic acid Openeye Name: 4-oxo-6-phenyl-1-(4-piperazin-1-ylphenyl)pyridine-3-carboxylic acid CAS Name: 4-oxo-6-phenyl-1-[4-(1-piperazinyl)phenyl]-3-pyridinecarboxylic acid IUPAC Name: 4-oxo-6-phenyl-1-(4-piperazin-1-ylphenyl)pyridine-3-carboxylic acid Traditional Name: 4-keto-6-phenyl-1-(4-piperazinophenyl)nicotinic acid Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C=C2)N3C=C(C(=O)C=C3C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C=C2)N3C=C(C(=O)C=C3C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C22H21N3O3/c26-21-14-20(16-4-2-1-3-5-16)25(15-19(21)22(27)28)18-8-6-17(7-9-18)24-12-10-23-11-13-24/h1-9,14-15,23H,10-13H2,(H,27,28)