2-(phenylmethoxycarbonylamino)ethyl 5-(2-methylpropyl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: 2-(phenylmethoxycarbonylamino)ethyl 5-(2-methylpropyl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: 2-(benzyloxycarbonylamino)ethyl 5-isobutyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-(2-methylpropyl)-1-phenyl-4-pyrazolecarboxylic acid 2-(phenylmethoxycarbonylamino)ethyl ester IUPAC Name: 2-(phenylmethoxycarbonylamino)ethyl 5-(2-methylpropyl)-1-phenylpyrazole-4-carboxylate Traditional Name: 5-isobutyl-1-phenyl-pyrazole-4-carboxylic acid 2-(benzyloxycarbonylamino)ethyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=NN1C2=CC=CC=C2)C(=O)OCCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=C(C=NN1C2=CC=CC=C2)C(=O)OCCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27N3O4/c1-18(2)15-22-21(16-26-27(22)20-11-7-4-8-12-20)23(28)30-14-13-25-24(29)31-17-19-9-5-3-6-10-19/h3-12,16,18H,13-15,17H2,1-2H3,(H,25,29)