2-(1-ethyl-2-methyl-indol-3-yl)carbonylterephthalic acid

Systemtic Name: 2-(1-ethyl-2-methyl-indol-3-yl)carbonylterephthalic acid Openeye Name: 2-(1-ethyl-2-methyl-indole-3-carbonyl)terephthalic acid CAS Name: 2-[(1-ethyl-2-methyl-3-indolyl)-oxomethyl]terephthalic acid IUPAC Name: 2-(1-ethyl-2-methylindole-3-carbonyl)terephthalic acid Traditional Name: 2-(1-ethyl-2-methyl-indole-3-carbonyl)terephthalic acid Formula: C20H17NO5 MolecularWeight: 351.35268

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C21)C(=O)C3=C(C=CC(=C3)C(=O)O)C(=O)O)C

InChI

InChI=1S/C20H17NO5/c1-3-21-11(2)17(14-6-4-5-7-16(14)21)18(22)15-10-12(19(23)24)8-9-13(15)20(25)26/h4-10H,3H2,1-2H3,(H,23,24)(H,25,26)