ethyl 1-(4-methylquinolin-2-yl)-5-[[(E)-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylquinolin-2-yl)-5-[[(E)-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(E)-3-(4-benzyloxyphenyl)prop-2-enoyl]amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylate CAS Name: 1-(4-methyl-2-quinolinyl)-5-[[(E)-1-oxo-3-(4-phenylmethoxyphenyl)prop-2-enyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylquinolin-2-yl)-5-[[(E)-3-(4-phenylmethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate Traditional Name: 5-[[(E)-3-(4-benzoxyphenyl)acryloyl]amino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C32H28N4O4 MolecularWeight: 532.58912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C=CC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)/C=C/C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C32H28N4O4/c1-3-39-32(38)27-20-33-36(29-19-22(2)26-11-7-8-12-28(26)34-29)31(27)35-30(37)18-15-23-13-16-25(17-14-23)40-21-24-9-5-4-6-10-24/h4-20H,3,21H2,1-2H3,(H,35,37)/b18-15+