[2-[cyclopenten-1-yl(ethyl)amino]-2-oxidanylidene-ethyl] 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoate

Systemtic Name: [2-[cyclopenten-1-yl(ethyl)amino]-2-oxidanylidene-ethyl] 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoate Openeye Name: [2-[cyclopenten-1-yl(ethyl)amino]-2-oxo-ethyl] 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetate CAS Name: 2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-oxoacetic acid [2-[1-cyclopentenyl(ethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclopenten-1-yl(ethyl)amino]-2-oxoethyl] 2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetate Traditional Name: 2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetic acid [2-[cyclopenten-1-yl(ethyl)amino]-2-keto-ethyl] ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CCCC1)C(=O)COC(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCN(C1=CCCC1)C(=O)COC(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O4/c1-4-24(17-10-8-9-11-17)19(26)14-29-22(28)21(27)20-15(2)23-25(16(20)3)18-12-6-5-7-13-18/h5-7,10,12-13H,4,8-9,11,14H2,1-3H3