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

Systemtic Name: ethyl (1R,2R,7S)-2-benzamido-5-methyl-3-oxidanylidene-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-6-carboxylate Openeye Name: ethyl (1R,2R,7S)-2-benzamido-5-methyl-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-6-carboxylate CAS Name: (1R,2R,7S)-2-benzamido-5-methyl-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl (1R,2R,7S)-2-benzamido-5-methyl-3-oxo-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-6-carboxylate Traditional Name: (1R,2R,7S)-2-benzamido-3-keto-5-methyl-1,7-diphenyl-2,7-dihydro-1H-pyrazolo[1,2-a]pyrazole-6-carboxylic acid ethyl ester Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=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

InChI

InChI=1S/C29H27N3O4/c1-3-36-29(35)23-19(2)31-28(34)24(30-27(33)22-17-11-6-12-18-22)26(21-15-9-5-10-16-21)32(31)25(23)20-13-7-4-8-14-20/h4-18,24-26H,3H2,1-2H3,(H,30,33)/t24-,25+,26-/m1/s1