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

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-propyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-propyl-pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-propyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-propylpyrazol-3-one Traditional Name: (4Z)-4-[1-(amylamino)ethylidene]-2-(4-nitrophenyl)-5-propyl-2-pyrazolin-3-one Formula: C19H26N4O3 MolecularWeight: 358.43474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=C1C(=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])CCC)C

Isomeric SMILES

CCCCCN/C(=C\1/C(=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])CCC)/C

InChI

InChI=1S/C19H26N4O3/c1-4-6-7-13-20-14(3)18-17(8-5-2)21-22(19(18)24)15-9-11-16(12-10-15)23(25)26/h9-12,20H,4-8,13H2,1-3H3/b18-14-