1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione

Systemtic Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Openeye Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione CAS Name: 1-[2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione IUPAC Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butane-1,4-dione Traditional Name: 1-[2-(2,4-dimethoxyphenyl)pyrrolidino]-4-(3-phenyl-2-pyrazolin-1-yl)butane-1,4-dione Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CCCN2C(=O)CCC(=O)N3CCC(=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H29N3O4/c1-31-19-10-11-20(23(17-19)32-2)22-9-6-15-27(22)24(29)12-13-25(30)28-16-14-21(26-28)18-7-4-3-5-8-18/h3-5,7-8,10-11,17,22H,6,9,12-16H2,1-2H3