1-[(4-tert-butylphenyl)methyl]-5-nitro-pyridin-2-one

Systemtic Name: 1-[(4-tert-butylphenyl)methyl]-5-nitro-pyridin-2-one Openeye Name: 1-[(4-tert-butylphenyl)methyl]-5-nitro-pyridin-2-one CAS Name: 1-[(4-tert-butylphenyl)methyl]-5-nitro-2-pyridinone IUPAC Name: 1-[(4-tert-butylphenyl)methyl]-5-nitropyridin-2-one Traditional Name: 1-(4-tert-butylbenzyl)-5-nitro-2-pyridone Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C=CC2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C=C(C=CC2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3/c1-16(2,3)13-6-4-12(5-7-13)10-17-11-14(18(20)21)8-9-15(17)19/h4-9,11H,10H2,1-3H3