[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate

Systemtic Name: [(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Openeye Name: [(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate CAS Name: 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylic acid [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Traditional Name: 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylic acid [(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=NN(C2=C1CCC2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)C1=NN(C2=C1CCC2)C3=CC=CC=C3

InChI

InChI=1S/C20H25N3O3/c1-13(2)12-21-19(24)14(3)26-20(25)18-16-10-7-11-17(16)23(22-18)15-8-5-4-6-9-15/h4-6,8-9,13-14H,7,10-12H2,1-3H3,(H,21,24)/t14-/m0/s1