[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylate Openeye Name: [2-(2-cyanoethylamino)-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 [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 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 [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N(N=C2C(=O)OCC(=O)NCCC#N)C3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C1)N(N=C2C(=O)OCC(=O)NCCC#N)C3=CC=CC=C3

InChI

InChI=1S/C18H18N4O3/c19-10-5-11-20-16(23)12-25-18(24)17-14-8-4-9-15(14)22(21-17)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-9,11-12H2,(H,20,23)