4-[[6-(4-piperidin-1-ylcarbonylphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]benzoic acid

Systemtic Name: 4-[[6-(4-piperidin-1-ylcarbonylphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]benzoic acid Openeye Name: 4-[[6-[4-(piperidine-1-carbonyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoic acid CAS Name: 4-[[6-[4-[oxo(1-piperidinyl)methyl]phenyl]-8-imidazo[1,2-a]pyrazinyl]amino]benzoic acid IUPAC Name: 4-[[6-[4-(piperidine-1-carbonyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoic acid Traditional Name: 4-[[6-[4-(piperidine-1-carbonyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]benzoic acid Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CN4C=CN=C4C(=N3)NC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CN4C=CN=C4C(=N3)NC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C25H23N5O3/c31-24(29-13-2-1-3-14-29)18-6-4-17(5-7-18)21-16-30-15-12-26-23(30)22(28-21)27-20-10-8-19(9-11-20)25(32)33/h4-12,15-16H,1-3,13-14H2,(H,27,28)(H,32,33)