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

Systemtic Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-phenyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-phenyl-pyrazol-3-one CAS Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-phenyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-nitrophenyl)-4-[1-(pentylamino)ethylidene]-5-phenylpyrazol-3-one Traditional Name: (4Z)-4-[1-(amylamino)ethylidene]-2-(4-nitrophenyl)-5-phenyl-2-pyrazolin-3-one Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=C1C(=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)C

Isomeric SMILES

CCCCCN/C(=C\1/C(=NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)/C

InChI

InChI=1S/C22H24N4O3/c1-3-4-8-15-23-16(2)20-21(17-9-6-5-7-10-17)24-25(22(20)27)18-11-13-19(14-12-18)26(28)29/h5-7,9-14,23H,3-4,8,15H2,1-2H3/b20-16-