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

Systemtic Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-morpholin-4-yl-methanone Openeye Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-morpholino-methanone CAS Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitrophenoxy)-3-pyrazolyl]-(4-morpholinyl)methanone IUPAC Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitrophenoxy)pyrazol-3-yl]-morpholin-4-ylmethanone Traditional Name: [1-tert-butyl-4-methyl-5-(3-methyl-4-nitro-phenoxy)pyrazol-3-yl]-morpholino-methanone Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)N3CCOCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=NN2C(C)(C)C)C(=O)N3CCOCC3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O5/c1-13-12-15(6-7-16(13)24(26)27)29-19-14(2)17(21-23(19)20(3,4)5)18(25)22-8-10-28-11-9-22/h6-7,12H,8-11H2,1-5H3