3,4,6-trimethyl-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1H-indole-2-carboxylic acid

Systemtic Name: 3,4,6-trimethyl-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1H-indole-2-carboxylic acid Openeye Name: 5-(4-hydroxy-3-isopropyl-phenoxy)-3,4,6-trimethyl-1H-indole-2-carboxylic acid CAS Name: 5-(4-hydroxy-3-propan-2-ylphenoxy)-3,4,6-trimethyl-1H-indole-2-carboxylic acid IUPAC Name: 5-(4-hydroxy-3-propan-2-ylphenoxy)-3,4,6-trimethyl-1H-indole-2-carboxylic acid Traditional Name: 5-(4-hydroxy-3-isopropyl-phenoxy)-3,4,6-trimethyl-1H-indole-2-carboxylic acid Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1OC3=CC(=C(C=C3)O)C(C)C)C)C(=C(N2)C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C(=C1OC3=CC(=C(C=C3)O)C(C)C)C)C(=C(N2)C(=O)O)C

InChI

InChI=1S/C21H23NO4/c1-10(2)15-9-14(6-7-17(15)23)26-20-11(3)8-16-18(13(20)5)12(4)19(22-16)21(24)25/h6-10,22-23H,1-5H3,(H,24,25)