ethyl 2,6-dimethyl-3-nitro-3-oxidanyl-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-3-nitro-3-oxidanyl-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylate Openeye Name: ethyl 3-hydroxy-2,6-dimethyl-3-nitro-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylate CAS Name: 3-hydroxy-2,6-dimethyl-3-nitro-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-hydroxy-2,6-dimethyl-3-nitro-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylate Traditional Name: 3-hydroxy-2,6-dimethyl-3-nitro-4-phenyl-2,4-dihydro-1H-pyridine-5-carboxylic acid ethyl ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(C(C1C2=CC=CC=C2)([N+](=O)[O-])O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(C(C1C2=CC=CC=C2)([N+](=O)[O-])O)C)C

InChI

InChI=1S/C16H20N2O5/c1-4-23-15(19)13-10(2)17-11(3)16(20,18(21)22)14(13)12-8-6-5-7-9-12/h5-9,11,14,17,20H,4H2,1-3H3