2-[2,5-dimethyl-1-(phenylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[2,5-dimethyl-1-(phenylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-(1-benzyl-2,5-dimethyl-indol-3-yl)acetic acid CAS Name: 2-[2,5-dimethyl-1-(phenylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-(1-benzyl-2,5-dimethylindol-3-yl)acetic acid Traditional Name: 2-(1-benzyl-2,5-dimethyl-indol-3-yl)acetic acid Formula: C19H19NO2 MolecularWeight: 293.35966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2CC(=O)O)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2CC(=O)O)C)CC3=CC=CC=C3

InChI

InChI=1S/C19H19NO2/c1-13-8-9-18-17(10-13)16(11-19(21)22)14(2)20(18)12-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,21,22)