5-(2,5-dimethylpyrrol-1-yl)-3-phenyl-1-(phenylmethyl)indole-2-carboxylic acid

Systemtic Name: 5-(2,5-dimethylpyrrol-1-yl)-3-phenyl-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-5-(2,5-dimethylpyrrol-1-yl)-3-phenyl-indole-2-carboxylic acid CAS Name: 5-(2,5-dimethyl-1-pyrrolyl)-3-phenyl-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-5-(2,5-dimethylpyrrol-1-yl)-3-phenylindole-2-carboxylic acid Traditional Name: 1-benzyl-5-(2,5-dimethylpyrrol-1-yl)-3-phenyl-indole-2-carboxylic acid Formula: C28H24N2O2 MolecularWeight: 420.50236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=C(N1C2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5)C

InChI

InChI=1S/C28H24N2O2/c1-19-13-14-20(2)30(19)23-15-16-25-24(17-23)26(22-11-7-4-8-12-22)27(28(31)32)29(25)18-21-9-5-3-6-10-21/h3-17H,18H2,1-2H3,(H,31,32)