3-[1-(4-pyrrolidin-1-ylphenyl)-1,2,4-triazol-3-yl]benzoic acid

Systemtic Name: 3-[1-(4-pyrrolidin-1-ylphenyl)-1,2,4-triazol-3-yl]benzoic acid Openeye Name: 3-[1-(4-pyrrolidin-1-ylphenyl)-1,2,4-triazol-3-yl]benzoic acid CAS Name: 3-[1-[4-(1-pyrrolidinyl)phenyl]-1,2,4-triazol-3-yl]benzoic acid IUPAC Name: 3-[1-(4-pyrrolidin-1-ylphenyl)-1,2,4-triazol-3-yl]benzoic acid Traditional Name: 3-[1-(4-pyrrolidinophenyl)-1,2,4-triazol-3-yl]benzoic acid Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)N3C=NC(=N3)C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)N3C=NC(=N3)C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C19H18N4O2/c24-19(25)15-5-3-4-14(12-15)18-20-13-23(21-18)17-8-6-16(7-9-17)22-10-1-2-11-22/h3-9,12-13H,1-2,10-11H2,(H,24,25)