2-[[4-methoxy-3-(4-methoxyphenyl)phenyl]amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-[[4-methoxy-3-(4-methoxyphenyl)phenyl]amino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-[4-methoxy-3-(4-methoxyphenyl)anilino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-[4-methoxy-3-(4-methoxyphenyl)anilino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 2-[4-methoxy-3-(4-methoxyphenyl)anilino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-[4-methoxy-3-(4-methoxyphenyl)anilino]-3-nitro-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C22H19N4O5+ MolecularWeight: 419.41006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC3=C(C(=O)[N+]4=CC=CC=C4N3)[N+](=O)[O-])OC

InChI

InChI=1S/C22H18N4O5/c1-30-16-9-6-14(7-10-16)17-13-15(8-11-18(17)31-2)23-21-20(26(28)29)22(27)25-12-4-3-5-19(25)24-21/h3-13H,1-2H3,(H,23,27)/p+1