[1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitrophenoxy)-3-pyrazolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitrophenoxy)pyrazol-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-pyrrolidino-methanone Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)N3CCCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)N3CCCC3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O4/c1-13-12-15(8-9-16(13)24(26)27)28-19-14(2)17(21-23(19)20(3,4)5)18(25)22-10-6-7-11-22/h8-9,12H,6-7,10-11H2,1-5H3