4-[1-[(4-bromophenyl)methyl]-5-chloranyl-2-methyl-indol-3-yl]-3,3-dimethyl-butanoic acid

Systemtic Name: 4-[1-[(4-bromophenyl)methyl]-5-chloranyl-2-methyl-indol-3-yl]-3,3-dimethyl-butanoic acid Openeye Name: 4-[1-[(4-bromophenyl)methyl]-5-chloro-2-methyl-indol-3-yl]-3,3-dimethyl-butanoic acid CAS Name: 4-[1-[(4-bromophenyl)methyl]-5-chloro-2-methyl-3-indolyl]-3,3-dimethylbutanoic acid IUPAC Name: 4-[1-[(4-bromophenyl)methyl]-5-chloro-2-methylindol-3-yl]-3,3-dimethylbutanoic acid Traditional Name: 4-[1-(4-bromobenzyl)-5-chloro-2-methyl-indol-3-yl]-3,3-dimethyl-butyric acid Formula: C22H23BrClNO2 MolecularWeight: 448.78052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)Cl)CC(C)(C)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Br)C=CC(=C2)Cl)CC(C)(C)CC(=O)O

InChI

InChI=1S/C22H23BrClNO2/c1-14-19(11-22(2,3)12-21(26)27)18-10-17(24)8-9-20(18)25(14)13-15-4-6-16(23)7-5-15/h4-10H,11-13H2,1-3H3,(H,26,27)