methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-(3-propan-2-yloxypropylamino)ethylidene]pyrazol-3-yl]ethanoate

Systemtic Name: methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-[1-(3-propan-2-yloxypropylamino)ethylidene]pyrazol-3-yl]ethanoate Openeye Name: methyl 2-[(4Z)-4-[1-(3-isopropoxypropylamino)ethylidene]-5-oxo-1-phenyl-pyrazol-3-yl]acetate CAS Name: 2-[(4Z)-5-oxo-1-phenyl-4-[1-(3-propan-2-yloxypropylamino)ethylidene]-3-pyrazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[(4Z)-5-oxo-1-phenyl-4-[1-(3-propan-2-yloxypropylamino)ethylidene]pyrazol-3-yl]acetate Traditional Name: 2-[(4Z)-4-[1-(3-isopropoxypropylamino)ethylidene]-5-keto-1-phenyl-2-pyrazolin-3-yl]acetic acid methyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=C1C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)C

Isomeric SMILES

CC(C)OCCCN/C(=C\1/C(=NN(C1=O)C2=CC=CC=C2)CC(=O)OC)/C

InChI

InChI=1S/C20H27N3O4/c1-14(2)27-12-8-11-21-15(3)19-17(13-18(24)26-4)22-23(20(19)25)16-9-6-5-7-10-16/h5-7,9-10,14,21H,8,11-13H2,1-4H3/b19-15-