ethyl 3-[3-[3-tert-butyl-5-(quinolin-8-ylcarbonylamino)pyrazol-1-yl]phenyl]propanoate

Systemtic Name: ethyl 3-[3-[3-tert-butyl-5-(quinolin-8-ylcarbonylamino)pyrazol-1-yl]phenyl]propanoate Openeye Name: ethyl 3-[3-[3-tert-butyl-5-(quinoline-8-carbonylamino)pyrazol-1-yl]phenyl]propanoate CAS Name: 3-[3-[3-tert-butyl-5-[[oxo(8-quinolinyl)methyl]amino]-1-pyrazolyl]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[3-tert-butyl-5-(quinoline-8-carbonylamino)pyrazol-1-yl]phenyl]propanoate Traditional Name: 3-[3-[3-tert-butyl-5-(quinoline-8-carbonylamino)pyrazol-1-yl]phenyl]propionic acid ethyl ester Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCOC(=O)CCC1=CC(=CC=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C28H30N4O3/c1-5-35-25(33)15-14-19-9-6-12-21(17-19)32-24(18-23(31-32)28(2,3)4)30-27(34)22-13-7-10-20-11-8-16-29-26(20)22/h6-13,16-18H,5,14-15H2,1-4H3,(H,30,34)