5-[(4-tert-butylphenyl)amino]-3-phenyl-1-[(4-phenylphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 5-[(4-tert-butylphenyl)amino]-3-phenyl-1-[(4-phenylphenyl)methyl]indole-2-carboxylic acid Openeye Name: 5-(4-tert-butylanilino)-3-phenyl-1-[(4-phenylphenyl)methyl]indole-2-carboxylic acid CAS Name: 5-(4-tert-butylanilino)-3-phenyl-1-[(4-phenylphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 5-(4-tert-butylanilino)-3-phenyl-1-[(4-phenylphenyl)methyl]indole-2-carboxylic acid Traditional Name: 5-(4-tert-butylanilino)-3-phenyl-1-(4-phenylbenzyl)indole-2-carboxylic acid Formula: C38H34N2O2 MolecularWeight: 550.68876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=CC3=C(C=C2)N(C(=C3C4=CC=CC=C4)C(=O)O)CC5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C38H34N2O2/c1-38(2,3)30-18-20-31(21-19-30)39-32-22-23-34-33(24-32)35(29-12-8-5-9-13-29)36(37(41)42)40(34)25-26-14-16-28(17-15-26)27-10-6-4-7-11-27/h4-24,39H,25H2,1-3H3,(H,41,42)