2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(3-fluoranyl-4-methoxy-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(3-fluoro-4-methoxy-benzoyl)piperazine-1-carboxylate CAS Name: 4-[(3-fluoro-4-methoxyphenyl)-oxomethyl]-1-piperazinecarboxylic acid 2-(3,5-diphenyl-1-pyrazolyl)ethyl ester IUPAC Name: 2-(3,5-diphenylpyrazol-1-yl)ethyl 4-(3-fluoro-4-methoxybenzoyl)piperazine-1-carboxylate Traditional Name: 4-(3-fluoro-4-methoxy-benzoyl)piperazine-1-carboxylic acid 2-(3,5-diphenylpyrazol-1-yl)ethyl ester Formula: C30H29FN4O4 MolecularWeight: 528.574063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)OCCN3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)OCCN3C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)F

InChI

InChI=1S/C30H29FN4O4/c1-38-28-13-12-24(20-25(28)31)29(36)33-14-16-34(17-15-33)30(37)39-19-18-35-27(23-10-6-3-7-11-23)21-26(32-35)22-8-4-2-5-9-22/h2-13,20-21H,14-19H2,1H3