5-[5-(2-methylbutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroindol-1-yl]furan-2-carboxylic acid

Systemtic Name: 5-[5-(2-methylbutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroindol-1-yl]furan-2-carboxylic acid Openeye Name: 5-[5-(1,1-dimethylpropyl)-2-phenyl-4,5,6,7-tetrahydroindol-1-yl]furan-2-carboxylic acid CAS Name: 5-[5-(2-methylbutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroindol-1-yl]-2-furancarboxylic acid IUPAC Name: 5-[5-(2-methylbutan-2-yl)-2-phenyl-4,5,6,7-tetrahydroindol-1-yl]furan-2-carboxylic acid Traditional Name: 5-(5-tert-amyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-furoic acid Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)C=C(N2C3=CC=C(O3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)C=C(N2C3=CC=C(O3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C24H27NO3/c1-4-24(2,3)18-10-11-19-17(14-18)15-20(16-8-6-5-7-9-16)25(19)22-13-12-21(28-22)23(26)27/h5-9,12-13,15,18H,4,10-11,14H2,1-3H3,(H,26,27)