2-[3-[(4-chlorophenyl)methyl]-2-methyl-1-propyl-indol-5-yl]oxy-2-methyl-propanoic acid

Systemtic Name: 2-[3-[(4-chlorophenyl)methyl]-2-methyl-1-propyl-indol-5-yl]oxy-2-methyl-propanoic acid Openeye Name: 2-[3-[(4-chlorophenyl)methyl]-2-methyl-1-propyl-indol-5-yl]oxy-2-methyl-propanoic acid CAS Name: 2-[[3-[(4-chlorophenyl)methyl]-2-methyl-1-propyl-5-indolyl]oxy]-2-methylpropanoic acid IUPAC Name: 2-[3-[(4-chlorophenyl)methyl]-2-methyl-1-propylindol-5-yl]oxy-2-methylpropanoic acid Traditional Name: 2-[3-(4-chlorobenzyl)-2-methyl-1-propyl-indol-5-yl]oxy-2-methyl-propionic acid Formula: C23H26ClNO3 MolecularWeight: 399.91044

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C1C=CC(=C2)OC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCCN1C(=C(C2=C1C=CC(=C2)OC(C)(C)C(=O)O)CC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H26ClNO3/c1-5-12-25-15(2)19(13-16-6-8-17(24)9-7-16)20-14-18(10-11-21(20)25)28-23(3,4)22(26)27/h6-11,14H,5,12-13H2,1-4H3,(H,26,27)