5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitro-pyridin-2-yl)amino]oxolan-2-one

Systemtic Name: 5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitro-pyridin-2-yl)amino]oxolan-2-one Openeye Name: 5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitro-2-pyridyl)amino]tetrahydrofuran-2-one CAS Name: 5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitro-2-pyridinyl)amino]-2-oxolanone IUPAC Name: 5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitropyridin-2-yl)amino]oxolan-2-one Traditional Name: 5-(4-tert-butylphenyl)-5-methyl-3-[(4-methyl-3-nitro-2-pyridyl)amino]tetrahydrofuran-2-one Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)NC2CC(OC2=O)(C)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC=C1)NC2CC(OC2=O)(C)C3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O4/c1-13-10-11-22-18(17(13)24(26)27)23-16-12-21(5,28-19(16)25)15-8-6-14(7-9-15)20(2,3)4/h6-11,16H,12H2,1-5H3,(H,22,23)