[2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)-3-pyrazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [2-(2,4-dimethylphenyl)-5-(4-nitrophenyl)pyrazol-3-yl]-pyrrolidino-methanone Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=CC(=N2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)N4CCCC4)C

InChI

InChI=1S/C22H22N4O3/c1-15-5-10-20(16(2)13-15)25-21(22(27)24-11-3-4-12-24)14-19(23-25)17-6-8-18(9-7-17)26(28)29/h5-10,13-14H,3-4,11-12H2,1-2H3