propan-2-yl 4-[[3-[(4-tert-butylphenoxy)methyl]phenyl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 4-[[3-[(4-tert-butylphenoxy)methyl]phenyl]carbonylamino]-1-ethyl-pyrazole-3-carboxylate Openeye Name: isopropyl 4-[[3-[(4-tert-butylphenoxy)methyl]benzoyl]amino]-1-ethyl-pyrazole-3-carboxylate CAS Name: 4-[[[3-[(4-tert-butylphenoxy)methyl]phenyl]-oxomethyl]amino]-1-ethyl-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[3-[(4-tert-butylphenoxy)methyl]benzoyl]amino]-1-ethylpyrazole-3-carboxylate Traditional Name: 4-[[3-[(4-tert-butylphenoxy)methyl]benzoyl]amino]-1-ethyl-pyrazole-3-carboxylic acid isopropyl ester Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC(C)C)NC(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H33N3O4/c1-7-30-16-23(24(29-30)26(32)34-18(2)3)28-25(31)20-10-8-9-19(15-20)17-33-22-13-11-21(12-14-22)27(4,5)6/h8-16,18H,7,17H2,1-6H3,(H,28,31)