(E)-4-[5-chloranyl-3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]but-3-en-2-one

Systemtic Name: (E)-4-[5-chloranyl-3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]but-3-en-2-one Openeye Name: (E)-4-[5-chloro-3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]but-3-en-2-one CAS Name: (E)-4-[5-chloro-3-(4-nitrophenyl)-1-phenyl-4-pyrazolyl]-3-buten-2-one IUPAC Name: (E)-4-[5-chloro-3-(4-nitrophenyl)-1-phenylpyrazol-4-yl]but-3-en-2-one Traditional Name: (E)-4-[5-chloro-3-(4-nitrophenyl)-1-phenyl-pyrazol-4-yl]but-3-en-2-one Formula: C19H14ClN3O3 MolecularWeight: 367.78576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=C(N(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)/C=C/C1=C(N(N=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H14ClN3O3/c1-13(24)7-12-17-18(14-8-10-16(11-9-14)23(25)26)21-22(19(17)20)15-5-3-2-4-6-15/h2-12H,1H3/b12-7+