2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[2-cyclohexyl-2-(dimethylamino)ethyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=C(C(=O)N2C=CC=CC2=N1)[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

CN(C)C(CNC1=C(C(=O)N2C=CC=CC2=N1)[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C18H25N5O3/c1-21(2)14(13-8-4-3-5-9-13)12-19-17-16(23(25)26)18(24)22-11-7-6-10-15(22)20-17/h6-7,10-11,13-14,19H,3-5,8-9,12H2,1-2H3