(E)-1-(azetidin-1-yl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(azetidin-1-yl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(azetidin-1-yl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-1-(1-azetidinyl)-3-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(azetidin-1-yl)-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]prop-2-en-1-one Traditional Name: (E)-1-(azetidin-1-yl)-3-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]prop-2-en-1-one Formula: C21H18ClN3O MolecularWeight: 363.84012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)C(=O)C=CC2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(C1)C(=O)/C=C/C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H18ClN3O/c22-18-10-7-16(8-11-18)21-17(9-12-20(26)24-13-4-14-24)15-25(23-21)19-5-2-1-3-6-19/h1-3,5-12,15H,4,13-14H2/b12-9+