(4Z)-2-(4-nitrophenyl)-4-[1-(oxolan-2-ylmethylamino)ethylidene]-5-propyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[1-(oxolan-2-ylmethylamino)ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-nitrophenyl)-5-propyl-4-[1-(tetrahydrofuran-2-ylmethylamino)ethylidene]pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[1-(2-oxolanylmethylamino)ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[1-(oxolan-2-ylmethylamino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-2-(4-nitrophenyl)-5-propyl-4-[1-(tetrahydrofurfurylamino)ethylidene]-2-pyrazolin-3-one Formula: C19H24N4O4 MolecularWeight: 372.41826

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C(C)NCC2CCCO2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C(/C)\NCC2CCCO2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O4/c1-3-5-17-18(13(2)20-12-16-6-4-11-27-16)19(24)22(21-17)14-7-9-15(10-8-14)23(25)26/h7-10,16,20H,3-6,11-12H2,1-2H3/b18-13-