4-(2-methyl-4-pyrazin-2-yl-phenyl)benzoic acid

Systemtic Name: 4-(2-methyl-4-pyrazin-2-yl-phenyl)benzoic acid Openeye Name: 4-(2-methyl-4-pyrazin-2-yl-phenyl)benzoic acid CAS Name: 4-[2-methyl-4-(2-pyrazinyl)phenyl]benzoic acid IUPAC Name: 4-(2-methyl-4-pyrazin-2-ylphenyl)benzoic acid Traditional Name: 4-(2-methyl-4-pyrazin-2-yl-phenyl)benzoic acid Formula: C18H14N2O2 MolecularWeight: 290.31596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC=CN=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC=CN=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O2/c1-12-10-15(17-11-19-8-9-20-17)6-7-16(12)13-2-4-14(5-3-13)18(21)22/h2-11H,1H3,(H,21,22)