3-phenyl-5-phenylmethoxy-1-[(4-phenylmethoxyphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 3-phenyl-5-phenylmethoxy-1-[(4-phenylmethoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 5-benzyloxy-1-[(4-benzyloxyphenyl)methyl]-3-phenyl-indole-2-carboxylic acid CAS Name: 3-phenyl-5-phenylmethoxy-1-[(4-phenylmethoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 3-phenyl-5-phenylmethoxy-1-[(4-phenylmethoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 5-benzoxy-1-(4-benzoxybenzyl)-3-phenyl-indole-2-carboxylic acid Formula: C36H29NO4 MolecularWeight: 539.61976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)OCC5=CC=CC=C5)C(=C3C(=O)O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)OCC5=CC=CC=C5)C(=C3C(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C36H29NO4/c38-36(39)35-34(29-14-8-3-9-15-29)32-22-31(41-25-28-12-6-2-7-13-28)20-21-33(32)37(35)23-26-16-18-30(19-17-26)40-24-27-10-4-1-5-11-27/h1-22H,23-25H2,(H,38,39)