2-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(2-nitro-4-pyrrolidinosulfonyl-phenoxy)methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C19H18N4O6S MolecularWeight: 430.43442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O6S/c24-19-11-14(20-18-5-1-2-10-22(18)19)13-29-17-7-6-15(12-16(17)23(25)26)30(27,28)21-8-3-4-9-21/h1-2,5-7,10-12H,3-4,8-9,13H2