5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-oxidanyl-benzoic acid Openeye Name: 5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-hydroxy-benzoic acid CAS Name: 5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-hydroxybenzoic acid IUPAC Name: 5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-hydroxybenzoic acid Traditional Name: 5-(5-tert-butyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-hydroxy-benzoic acid Formula: C25H27NO3 MolecularWeight: 389.48678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO3/c1-25(2,3)18-9-11-21-17(13-18)14-22(16-7-5-4-6-8-16)26(21)19-10-12-23(27)20(15-19)24(28)29/h4-8,10,12,14-15,18,27H,9,11,13H2,1-3H3,(H,28,29)