1-(4-cyclopropylcarbonylpiperazin-1-yl)-4-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]butane-1,4-dione

Systemtic Name: 1-(4-cyclopropylcarbonylpiperazin-1-yl)-4-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]butane-1,4-dione Openeye Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-4-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]butane-1,4-dione CAS Name: 1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-4-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]butane-1,4-dione IUPAC Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-4-[(3R)-3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]butane-1,4-dione Traditional Name: 1-[4-(cyclopropanecarbonyl)piperazino]-4-[(5R)-5-(4-methoxyphenyl)-3-phenyl-2-pyrazolin-1-yl]butane-1,4-dione Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=NN2C(=O)CCC(=O)N3CCN(CC3)C(=O)C4CC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=NN2C(=O)CCC(=O)N3CCN(CC3)C(=O)C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H32N4O4/c1-36-23-11-9-21(10-12-23)25-19-24(20-5-3-2-4-6-20)29-32(25)27(34)14-13-26(33)30-15-17-31(18-16-30)28(35)22-7-8-22/h2-6,9-12,22,25H,7-8,13-19H2,1H3/t25-/m1/s1