2-[4-[2-methyl-1,3-bis(phenylmethyl)indol-5-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-methyl-1,3-bis(phenylmethyl)indol-5-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-(1,3-dibenzyl-2-methyl-indol-5-yl)phenoxy]acetic acid CAS Name: 2-[4-[2-methyl-1,3-bis(phenylmethyl)-5-indolyl]phenoxy]acetic acid IUPAC Name: 2-[4-(1,3-dibenzyl-2-methylindol-5-yl)phenoxy]acetic acid Traditional Name: 2-[4-(1,3-dibenzyl-2-methyl-indol-5-yl)phenoxy]acetic acid Formula: C31H27NO3 MolecularWeight: 461.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C4=CC=C(C=C4)OCC(=O)O)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C4=CC=C(C=C4)OCC(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C31H27NO3/c1-22-28(18-23-8-4-2-5-9-23)29-19-26(25-12-15-27(16-13-25)35-21-31(33)34)14-17-30(29)32(22)20-24-10-6-3-7-11-24/h2-17,19H,18,20-21H2,1H3,(H,33,34)