3-ethyl-3-(1-oxidanyl-1-oxidanylidene-butan-2-yl)indole-2-carboxylic acid

Systemtic Name: 3-ethyl-3-(1-oxidanyl-1-oxidanylidene-butan-2-yl)indole-2-carboxylic acid Openeye Name: 3-(1-carboxypropyl)-3-ethyl-indole-2-carboxylic acid CAS Name: 3-ethyl-3-(1-hydroxy-1-oxobutan-2-yl)-2-indolecarboxylic acid IUPAC Name: 3-ethyl-3-(1-hydroxy-1-oxobutan-2-yl)indole-2-carboxylic acid Traditional Name: 3-(1-carboxypropyl)-3-ethyl-indole-2-carboxylic acid Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)C1(C2=CC=CC=C2N=C1C(=O)O)CC

Isomeric SMILES

CCC(C(=O)O)C1(C2=CC=CC=C2N=C1C(=O)O)CC

InChI

InChI=1S/C15H17NO4/c1-3-9(13(17)18)15(4-2)10-7-5-6-8-11(10)16-12(15)14(19)20/h5-9H,3-4H2,1-2H3,(H,17,18)(H,19,20)