[2-[(E)-2-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)ethenyl]quinolin-8-yl] propanoate

Systemtic Name: [2-[(E)-2-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)ethenyl]quinolin-8-yl] propanoate Openeye Name: [2-[(E)-2-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)vinyl]-8-quinolyl] propanoate CAS Name: propanoic acid [2-[(E)-2-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)ethenyl]-8-quinolinyl] ester IUPAC Name: [2-[(E)-2-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)ethenyl]quinolin-8-yl] propanoate Traditional Name: propionic acid [2-[(E)-2-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)vinyl]-8-quinolyl] ester Formula: C24H20ClN3O2 MolecularWeight: 417.8875

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CC=CC2=C1N=C(C=C2)C=CC3=C(N(N=C3C)C4=CC=CC=C4)Cl

Isomeric SMILES

CCC(=O)OC1=CC=CC2=C1N=C(C=C2)/C=C/C3=C(N(N=C3C)C4=CC=CC=C4)Cl

InChI

InChI=1S/C24H20ClN3O2/c1-3-22(29)30-21-11-7-8-17-12-13-18(26-23(17)21)14-15-20-16(2)27-28(24(20)25)19-9-5-4-6-10-19/h4-15H,3H2,1-2H3/b15-14+