3-azanyl-2-methyl-5-[2-methyl-5-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]pyrrol-1-yl]benzoic acid

Systemtic Name: 3-azanyl-2-methyl-5-[2-methyl-5-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]pyrrol-1-yl]benzoic acid Openeye Name: 3-amino-5-[2-[2-benzyloxy-5-(trifluoromethyl)phenyl]-5-methyl-pyrrol-1-yl]-2-methyl-benzoic acid CAS Name: 3-amino-2-methyl-5-[2-methyl-5-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]-1-pyrrolyl]benzoic acid IUPAC Name: 3-amino-2-methyl-5-[2-methyl-5-[2-phenylmethoxy-5-(trifluoromethyl)phenyl]pyrrol-1-yl]benzoic acid Traditional Name: 3-amino-5-[2-[2-benzoxy-5-(trifluoromethyl)phenyl]-5-methyl-pyrrol-1-yl]-2-methyl-benzoic acid Formula: C27H23F3N2O3 MolecularWeight: 480.47833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC(=C(C(=C2)C(=O)O)C)N)C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(N1C2=CC(=C(C(=C2)C(=O)O)C)N)C3=C(C=CC(=C3)C(F)(F)F)OCC4=CC=CC=C4

InChI

InChI=1S/C27H23F3N2O3/c1-16-8-10-24(32(16)20-13-21(26(33)34)17(2)23(31)14-20)22-12-19(27(28,29)30)9-11-25(22)35-15-18-6-4-3-5-7-18/h3-14H,15,31H2,1-2H3,(H,33,34)