[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone

Systemtic Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Openeye Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone CAS Name: [2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-[1-(4-nitrophenyl)-4-pyrazolyl]methanone IUPAC Name: [2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Traditional Name: [2-(2,5-dimethoxyphenyl)pyrrolidino]-[1-(4-nitrophenyl)pyrazol-4-yl]methanone Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)C3=CN(N=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5/c1-30-18-9-10-21(31-2)19(12-18)20-4-3-11-24(20)22(27)15-13-23-25(14-15)16-5-7-17(8-6-16)26(28)29/h5-10,12-14,20H,3-4,11H2,1-2H3