1-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxidanylidene-quinazolin-2-yl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxidanylidene-quinazolin-2-yl]methyl]piperidine-4-carboxamide Openeye Name: 1-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxo-quinazolin-2-yl]methyl]piperidine-4-carboxamide CAS Name: 1-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxo-2-quinazolinyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[[3-(2,4-dimethoxyphenyl)-6-nitro-4-oxoquinazolin-2-yl]methyl]piperidine-4-carboxamide Traditional Name: 1-[[3-(2,4-dimethoxyphenyl)-4-keto-6-nitro-quinazolin-2-yl]methyl]isonipecotamide Formula: C23H25N5O6 MolecularWeight: 467.4745

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CN4CCC(CC4)C(=O)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CN4CCC(CC4)C(=O)N)OC

InChI

InChI=1S/C23H25N5O6/c1-33-16-4-6-19(20(12-16)34-2)27-21(13-26-9-7-14(8-10-26)22(24)29)25-18-5-3-15(28(31)32)11-17(18)23(27)30/h3-6,11-12,14H,7-10,13H2,1-2H3,(H2,24,29)