2-[5-bromanyl-2-methyl-1-[(3-phenylmethoxyphenyl)methyl]indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-bromanyl-2-methyl-1-[(3-phenylmethoxyphenyl)methyl]indol-3-yl]ethanoic acid Openeye Name: 2-[1-[(3-benzyloxyphenyl)methyl]-5-bromo-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[5-bromo-2-methyl-1-[(3-phenylmethoxyphenyl)methyl]-3-indolyl]acetic acid IUPAC Name: 2-[5-bromo-2-methyl-1-[(3-phenylmethoxyphenyl)methyl]indol-3-yl]acetic acid Traditional Name: 2-[1-(3-benzoxybenzyl)-5-bromo-2-methyl-indol-3-yl]acetic acid Formula: C25H22BrNO3 MolecularWeight: 464.35108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC(=CC=C3)OCC4=CC=CC=C4)C=CC(=C2)Br)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC(=CC=C3)OCC4=CC=CC=C4)C=CC(=C2)Br)CC(=O)O

InChI

InChI=1S/C25H22BrNO3/c1-17-22(14-25(28)29)23-13-20(26)10-11-24(23)27(17)15-19-8-5-9-21(12-19)30-16-18-6-3-2-4-7-18/h2-13H,14-16H2,1H3,(H,28,29)