(E)-1-(azetidin-1-yl)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(azetidin-1-yl)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(azetidin-1-yl)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(1-azetidinyl)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(azetidin-1-yl)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(azetidin-1-yl)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-en-1-one Formula: C16H16ClN3O MolecularWeight: 301.77074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)N2CCC2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)N2CCC2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H16ClN3O/c1-12-14(8-9-15(21)19-10-5-11-19)16(17)20(18-12)13-6-3-2-4-7-13/h2-4,6-9H,5,10-11H2,1H3/b9-8+