7-chloranyl-2-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-chloranyl-2-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-chloro-2-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-chloro-2-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-chloro-2-[[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-chloro-2-[[4-(3-nitrophenyl)sulfonylpiperazino]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C19H19ClN5O5S+ MolecularWeight: 464.90266

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN5O5S/c20-14-4-5-18-21-15(10-19(26)24(18)12-14)13-22-6-8-23(9-7-22)31(29,30)17-3-1-2-16(11-17)25(27)28/h1-5,10-12H,6-9,13H2/p+1