N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-oxo-pyrido[1,2-a]pyrimidine-3-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-oxo-3-pyrido[1,2-a]pyrimidinecarboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-4-keto-pyrido[1,2-a]pyrimidine-3-carboxamide Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CN=C3C=CC=CN3C2=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CN=C3C=CC=CN3C2=O)[N+](=O)[O-])OC

InChI

InChI=1S/C19H18N4O6/c1-28-15-9-12(14(23(26)27)10-16(15)29-2)6-7-20-18(24)13-11-21-17-5-3-4-8-22(17)19(13)25/h3-5,8-11H,6-7H2,1-2H3,(H,20,24)