6-(3-bromanyl-4,5-diethoxy-phenyl)-5-nitro-piperidin-2-one

Systemtic Name: 6-(3-bromanyl-4,5-diethoxy-phenyl)-5-nitro-piperidin-2-one Openeye Name: 6-(3-bromo-4,5-diethoxy-phenyl)-5-nitro-piperidin-2-one CAS Name: 6-(3-bromo-4,5-diethoxyphenyl)-5-nitro-2-piperidinone IUPAC Name: 6-(3-bromo-4,5-diethoxyphenyl)-5-nitropiperidin-2-one Traditional Name: 6-(3-bromo-4,5-diethoxy-phenyl)-5-nitro-2-piperidone Formula: C15H19BrN2O5 MolecularWeight: 387.22576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(CCC(=O)N2)[N+](=O)[O-])Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(CCC(=O)N2)[N+](=O)[O-])Br)OCC

InChI

InChI=1S/C15H19BrN2O5/c1-3-22-12-8-9(7-10(16)15(12)23-4-2)14-11(18(20)21)5-6-13(19)17-14/h7-8,11,14H,3-6H2,1-2H3,(H,17,19)