3-[3-(5-chloranylthiophen-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: 3-[3-(5-chloranylthiophen-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: 3-[3-(5-chloro-2-thienyl)-1-phenyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: 3-[3-(5-chloro-2-thiophenyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: 3-[3-(5-chlorothiophen-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoic acid Traditional Name: 3-[3-(5-chloro-2-thienyl)-1-phenyl-pyrazol-4-yl]acrylic acid Formula: C16H11ClN2O2S MolecularWeight: 330.78874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)Cl)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)Cl)C=CC(=O)O

InChI

InChI=1S/C16H11ClN2O2S/c17-14-8-7-13(22-14)16-11(6-9-15(20)21)10-19(18-16)12-4-2-1-3-5-12/h1-10H,(H,20,21)