5-(4-tert-butylphenyl)-1,3-bis(4-propan-2-yloxyphenyl)indole-2-carboxylic acid

Systemtic Name: 5-(4-tert-butylphenyl)-1,3-bis(4-propan-2-yloxyphenyl)indole-2-carboxylic acid Openeye Name: 5-(4-tert-butylphenyl)-1,3-bis(4-isopropoxyphenyl)indole-2-carboxylic acid CAS Name: 5-(4-tert-butylphenyl)-1,3-bis(4-propan-2-yloxyphenyl)-2-indolecarboxylic acid IUPAC Name: 5-(4-tert-butylphenyl)-1,3-bis(4-propan-2-yloxyphenyl)indole-2-carboxylic acid Traditional Name: 5-(4-tert-butylphenyl)-1,3-bis(4-isopropoxyphenyl)indole-2-carboxylic acid Formula: C37H39NO4 MolecularWeight: 561.70986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(C=C5)OC(C)C)C(=O)O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=C(N(C3=C2C=C(C=C3)C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(C=C5)OC(C)C)C(=O)O

InChI

InChI=1S/C37H39NO4/c1-23(2)41-30-17-10-26(11-18-30)34-32-22-27(25-8-13-28(14-9-25)37(5,6)7)12-21-33(32)38(35(34)36(39)40)29-15-19-31(20-16-29)42-24(3)4/h8-24H,1-7H3,(H,39,40)