(E)-1-[3-(2-chloroethyl)-4-oxidanyl-phenyl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(2-chloroethyl)-4-oxidanyl-phenyl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-[3-(2-chloroethyl)-4-hydroxy-phenyl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-[3-(2-chloroethyl)-4-hydroxyphenyl]-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(2-chloroethyl)-4-hydroxyphenyl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[3-(2-chloroethyl)-4-hydroxy-phenyl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C20H17ClN2O2 MolecularWeight: 352.81418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)C3=CC(=C(C=C3)O)CCCl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)C3=CC(=C(C=C3)O)CCCl

InChI

InChI=1S/C20H17ClN2O2/c21-11-10-17-12-16(7-9-20(17)25)19(24)8-6-15-13-22-23(14-15)18-4-2-1-3-5-18/h1-9,12-14,25H,10-11H2/b8-6+