methyl 2-[4-[C-methyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]carbonimidoyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[4-[C-methyl-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]carbonimidoyl]-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[4-[C-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]carbonimidoyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate CAS Name: 2-[5-oxo-4-[1-[3-(2-oxo-1-pyrrolidinyl)propylimino]ethyl]-1-phenyl-4H-pyrazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[C-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]carbonimidoyl]-5-oxo-1-phenyl-4H-pyrazol-3-yl]acetate Traditional Name: 2-[5-keto-4-[N-[3-(2-ketopyrrolidino)propyl]-C-methyl-carbonimidoyl]-1-phenyl-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCN1CCCC1=O)C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OC

Isomeric SMILES

CC(=NCCCN1CCCC1=O)C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OC

InChI

InChI=1S/C21H26N4O4/c1-15(22-11-7-13-24-12-6-10-18(24)26)20-17(14-19(27)29-2)23-25(21(20)28)16-8-4-3-5-9-16/h3-5,8-9,20H,6-7,10-14H2,1-2H3