7-[4-(diphenylmethyl)pyrazol-1-yl]-2-phenoxy-heptanoic acid

Systemtic Name: 7-[4-(diphenylmethyl)pyrazol-1-yl]-2-phenoxy-heptanoic acid Openeye Name: 7-(4-benzhydrylpyrazol-1-yl)-2-phenoxy-heptanoic acid CAS Name: 7-[4-(diphenylmethyl)-1-pyrazolyl]-2-phenoxyheptanoic acid IUPAC Name: 7-(4-benzhydrylpyrazol-1-yl)-2-phenoxyheptanoic acid Traditional Name: 7-(4-benzhydrylpyrazol-1-yl)-2-phenoxy-enanthic acid Formula: C29H30N2O3 MolecularWeight: 454.5601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN(N=C3)CCCCCC(C(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CN(N=C3)CCCCCC(C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C29H30N2O3/c32-29(33)27(34-26-17-9-3-10-18-26)19-11-4-12-20-31-22-25(21-30-31)28(23-13-5-1-6-14-23)24-15-7-2-8-16-24/h1-3,5-10,13-18,21-22,27-28H,4,11-12,19-20H2,(H,32,33)