4-[3-chloranyl-2-oxidanylidene-4-[(E)-2-phenylethenyl]azetidin-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[3-chloranyl-2-oxidanylidene-4-[(E)-2-phenylethenyl]azetidin-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[3-chloro-2-oxo-4-[(E)-styryl]azetidin-1-yl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[3-chloro-2-oxo-4-[(E)-2-phenylethenyl]-1-azetidinyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[3-chloro-2-oxo-4-[(E)-2-phenylethenyl]azetidin-1-yl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[3-chloro-2-keto-4-[(E)-styryl]azetidin-1-yl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C22H20ClN3O2 MolecularWeight: 393.8661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(C(C3=O)Cl)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(C(C3=O)Cl)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN3O2/c1-15-20(22(28)26(24(15)2)17-11-7-4-8-12-17)25-18(19(23)21(25)27)14-13-16-9-5-3-6-10-16/h3-14,18-19H,1-2H3/b14-13+