dimethyl (1R,2R,7S)-2-benzamido-3-oxidanylidene-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylate

Systemtic Name: dimethyl (1R,2R,7S)-2-benzamido-3-oxidanylidene-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylate Openeye Name: dimethyl (1R,2R,7S)-2-benzamido-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylate CAS Name: (1R,2R,7S)-2-benzamido-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1R,2R,7S)-2-benzamido-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylate Traditional Name: (1R,2R,7S)-2-benzamido-3-keto-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-5,6-dicarboxylic acid dimethyl ester Formula: C29H25N3O6 MolecularWeight: 511.5253

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N2C(=O)C(C(N2C1C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(N2C(=O)[C@@H]([C@H](N2[C@H]1C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C29H25N3O6/c1-37-28(35)21-23(18-12-6-3-7-13-18)31-24(19-14-8-4-9-15-19)22(27(34)32(31)25(21)29(36)38-2)30-26(33)20-16-10-5-11-17-20/h3-17,22-24H,1-2H3,(H,30,33)/t22-,23+,24-/m1/s1