1,5-dimethyl-4-[(3-nitro-4-propan-2-yl-phenyl)methylideneamino]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[(3-nitro-4-propan-2-yl-phenyl)methylideneamino]-2-phenyl-pyrazol-3-one Openeye Name: 4-[(4-isopropyl-3-nitro-phenyl)methyleneamino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[(3-nitro-4-propan-2-ylphenyl)methylideneamino]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[(3-nitro-4-propan-2-ylphenyl)methylideneamino]-2-phenylpyrazol-3-one Traditional Name: 4-[(4-isopropyl-3-nitro-benzylidene)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=CC(=C(C=C3)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3/c1-14(2)18-11-10-16(12-19(18)25(27)28)13-22-20-15(3)23(4)24(21(20)26)17-8-6-5-7-9-17/h5-14H,1-4H3