prop-2-enyl (4R,5S,6R)-6-methyl-6-oxidanyl-3-oxidanylidene-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate

Systemtic Name: prop-2-enyl (4R,5S,6R)-6-methyl-6-oxidanyl-3-oxidanylidene-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate Openeye Name: allyl (4R,5S,6R)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate CAS Name: (4R,5S,6R)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R,5S,6R)-6-hydroxy-6-methyl-3-oxo-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylate Traditional Name: (4R,5S,6R)-6-hydroxy-3-keto-6-methyl-4-phenyl-2,4,5,7-tetrahydro-1H-indazole-5-carboxylic acid allyl ester Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C1C(=O)OCC=C)C3=CC=CC=C3)C(=O)NN2)O

Isomeric SMILES

C[C@]1(CC2=C([C@H]([C@@H]1C(=O)OCC=C)C3=CC=CC=C3)C(=O)NN2)O

InChI

InChI=1S/C18H20N2O4/c1-3-9-24-17(22)15-13(11-7-5-4-6-8-11)14-12(10-18(15,2)23)19-20-16(14)21/h3-8,13,15,23H,1,9-10H2,2H3,(H2,19,20,21)/t13-,15-,18-/m1/s1