ethyl 1-quinolin-2-yl-5-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-quinolin-2-yl-5-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(2-quinolyl)-5-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[(E)-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-quinolin-2-yl-5-[[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]amino]pyrazole-4-carboxylate Traditional Name: 1-(2-quinolyl)-5-[[(E)-3-(3,4,5-trimethoxyphenyl)acryloyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C27H26N4O6 MolecularWeight: 502.51854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H26N4O6/c1-5-37-27(33)19-16-28-31(23-12-11-18-8-6-7-9-20(18)29-23)26(19)30-24(32)13-10-17-14-21(34-2)25(36-4)22(15-17)35-3/h6-16H,5H2,1-4H3,(H,30,32)/b13-10+