2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]ethanoic acid Openeye Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]acetic acid CAS Name: 2-[2-(1-adamantyl)-5-phenyl-1-pyrrolyl]acetic acid IUPAC Name: 2-[2-(1-adamantyl)-5-phenylpyrrol-1-yl]acetic acid Traditional Name: 2-[2-(1-adamantyl)-5-phenyl-pyrrol-1-yl]acetic acid Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(N4CC(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(N4CC(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C22H25NO2/c24-21(25)14-23-19(18-4-2-1-3-5-18)6-7-20(23)22-11-15-8-16(12-22)10-17(9-15)13-22/h1-7,15-17H,8-14H2,(H,24,25)