2-[2-ethyl-5-methyl-1-(phenylmethyl)indol-3-yl]ethanoic acid; sodium

Systemtic Name: 2-[2-ethyl-5-methyl-1-(phenylmethyl)indol-3-yl]ethanoic acid; sodium Openeye Name: 2-(1-benzyl-2-ethyl-5-methyl-indol-3-yl)acetic acid; sodium CAS Name: 2-[2-ethyl-5-methyl-1-(phenylmethyl)-3-indolyl]acetic acid; sodium IUPAC Name: 2-(1-benzyl-2-ethyl-5-methylindol-3-yl)acetic acid; sodium Traditional Name: 2-(1-benzyl-2-ethyl-5-methyl-indol-3-yl)acetic acid; sodium Formula: C20H21NNaO2 MolecularWeight: 330.37601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C)CC(=O)O.[Na]

Isomeric SMILES

CCC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)C)CC(=O)O.[Na]

InChI

InChI=1S/C20H21NO2.Na/c1-3-18-17(12-20(22)23)16-11-14(2)9-10-19(16)21(18)13-15-7-5-4-6-8-15;/h4-11H,3,12-13H2,1-2H3,(H,22,23);