2-[[5-(4-tert-butylphenyl)-1-(4-cyclopentyloxyphenyl)indol-2-yl]carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[5-(4-tert-butylphenyl)-1-(4-cyclopentyloxyphenyl)indol-2-yl]carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[[5-(4-tert-butylphenyl)-1-[4-(cyclopentoxy)phenyl]indole-2-carbonyl]-methyl-amino]acetic acid CAS Name: 2-[[[5-(4-tert-butylphenyl)-1-(4-cyclopentyloxyphenyl)-2-indolyl]-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[[5-(4-tert-butylphenyl)-1-(4-cyclopentyloxyphenyl)indole-2-carbonyl]-methylamino]acetic acid Traditional Name: 2-[[5-(4-tert-butylphenyl)-1-[4-(cyclopentoxy)phenyl]indole-2-carbonyl]-methyl-amino]acetic acid Formula: C33H36N2O4 MolecularWeight: 524.64994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C(=C3)C(=O)N(C)CC(=O)O)C4=CC=C(C=C4)OC5CCCC5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC3=C(C=C2)N(C(=C3)C(=O)N(C)CC(=O)O)C4=CC=C(C=C4)OC5CCCC5

InChI

InChI=1S/C33H36N2O4/c1-33(2,3)25-12-9-22(10-13-25)23-11-18-29-24(19-23)20-30(32(38)34(4)21-31(36)37)35(29)26-14-16-28(17-15-26)39-27-7-5-6-8-27/h9-20,27H,5-8,21H2,1-4H3,(H,36,37)