3-[[(3-phenylpyrido[2,3-b]pyrazin-6-yl)amino]methyl]benzoic acid

Systemtic Name: 3-[[(3-phenylpyrido[2,3-b]pyrazin-6-yl)amino]methyl]benzoic acid Openeye Name: 3-[[(3-phenylpyrido[2,3-b]pyrazin-6-yl)amino]methyl]benzoic acid CAS Name: 3-[[(3-phenyl-6-pyrido[2,3-b]pyrazinyl)amino]methyl]benzoic acid IUPAC Name: 3-[[(3-phenylpyrido[2,3-b]pyrazin-6-yl)amino]methyl]benzoic acid Traditional Name: 3-[[(3-phenylpyrido[2,3-b]pyrazin-6-yl)amino]methyl]benzoic acid Formula: C21H16N4O2 MolecularWeight: 356.37734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C3C=CC(=NC3=N2)NCC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C3C=CC(=NC3=N2)NCC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H16N4O2/c26-21(27)16-8-4-5-14(11-16)12-23-19-10-9-17-20(25-19)24-18(13-22-17)15-6-2-1-3-7-15/h1-11,13H,12H2,(H,26,27)(H,23,24,25)