(5R)-5-tert-butyl-1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate

Systemtic Name: (5R)-5-tert-butyl-1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Openeye Name: (5R)-5-tert-butyl-1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate CAS Name: (5R)-5-tert-butyl-1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate IUPAC Name: (5R)-5-tert-butyl-1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylate Traditional Name: (5R)-5-tert-butyl-1-p-phenetyl-4,5,6,7-tetrahydroindazole-3-carboxylate Formula: C20H25N2O3- MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=C(CC(CC3)C(C)(C)C)C(=N2)C(=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=C(C[C@@H](CC3)C(C)(C)C)C(=N2)C(=O)[O-]

InChI

InChI=1S/C20H26N2O3/c1-5-25-15-9-7-14(8-10-15)22-17-11-6-13(20(2,3)4)12-16(17)18(21-22)19(23)24/h7-10,13H,5-6,11-12H2,1-4H3,(H,23,24)/p-1/t13-/m1/s1