4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethoxy)-3-(phenylmethyl)-1H-indole-2-carboxylic acid

Systemtic Name: 4-(2-oxidanyl-2-oxidanylidene-1-phenyl-ethoxy)-3-(phenylmethyl)-1H-indole-2-carboxylic acid Openeye Name: 3-benzyl-4-(2-hydroxy-2-oxo-1-phenyl-ethoxy)-1H-indole-2-carboxylic acid CAS Name: 4-(2-hydroxy-2-oxo-1-phenylethoxy)-3-(phenylmethyl)-1H-indole-2-carboxylic acid IUPAC Name: 3-benzyl-4-(2-hydroxy-2-oxo-1-phenylethoxy)-1H-indole-2-carboxylic acid Traditional Name: 3-benzyl-4-(2-hydroxy-2-keto-1-phenyl-ethoxy)-1H-indole-2-carboxylic acid Formula: C24H19NO5 MolecularWeight: 401.41136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(NC3=C2C(=CC=C3)OC(C4=CC=CC=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(NC3=C2C(=CC=C3)OC(C4=CC=CC=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C24H19NO5/c26-23(27)21-17(14-15-8-3-1-4-9-15)20-18(25-21)12-7-13-19(20)30-22(24(28)29)16-10-5-2-6-11-16/h1-13,22,25H,14H2,(H,26,27)(H,28,29)