3-[3-butan-2-yloxy-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-indol-2-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[3-butan-2-yloxy-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-indol-2-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-5-isopropyl-3-sec-butoxy-indol-2-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[3-butan-2-yloxy-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-2-indolyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[3-butan-2-yloxy-1-[(4-chlorophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-5-isopropyl-3-sec-butoxy-indol-2-yl]-2,2-dimethyl-propionic acid Formula: C27H34ClNO3 MolecularWeight: 456.01676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(N(C2=C1C=C(C=C2)C(C)C)CC3=CC=C(C=C3)Cl)CC(C)(C)C(=O)O

Isomeric SMILES

CCC(C)OC1=C(N(C2=C1C=C(C=C2)C(C)C)CC3=CC=C(C=C3)Cl)CC(C)(C)C(=O)O

InChI

InChI=1S/C27H34ClNO3/c1-7-18(4)32-25-22-14-20(17(2)3)10-13-23(22)29(16-19-8-11-21(28)12-9-19)24(25)15-27(5,6)26(30)31/h8-14,17-18H,7,15-16H2,1-6H3,(H,30,31)