5-methyl-4-[[3-[(4-nitrophenyl)amino]propylamino]methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: 5-methyl-4-[[3-[(4-nitrophenyl)amino]propylamino]methylidene]-2-phenyl-pyrazol-3-one Openeye Name: 5-methyl-4-[[3-(4-nitroanilino)propylamino]methylene]-2-phenyl-pyrazol-3-one CAS Name: 5-methyl-4-[[3-(4-nitroanilino)propylamino]methylidene]-2-phenyl-3-pyrazolone IUPAC Name: 5-methyl-4-[[3-(4-nitroanilino)propylamino]methylidene]-2-phenylpyrazol-3-one Traditional Name: 5-methyl-4-[[3-(4-nitroanilino)propylamino]methylene]-2-phenyl-2-pyrazolin-3-one Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCCCNC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1=CNCCCNC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H21N5O3/c1-15-19(20(26)24(23-15)17-6-3-2-4-7-17)14-21-12-5-13-22-16-8-10-18(11-9-16)25(27)28/h2-4,6-11,14,21-22H,5,12-13H2,1H3