2-[[2-(diethylamino)-3-phenyl-propyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-[[2-(diethylamino)-3-phenyl-propyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[[2-(diethylamino)-3-phenyl-propyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[[2-(diethylamino)-3-phenylpropyl]amino]-3-nitro-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-[[2-(diethylamino)-3-phenylpropyl]amino]-3-nitropyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[[2-(diethylamino)-3-phenyl-propyl]amino]-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC1=CC=CC=C1)CNC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(CC1=CC=CC=C1)CNC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O3/c1-3-24(4-2)17(14-16-10-6-5-7-11-16)15-22-20-19(26(28)29)21(27)25-13-9-8-12-18(25)23-20/h5-13,17,22H,3-4,14-15H2,1-2H3