3-nitro-2-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 3-nitro-2-[4-(4-propan-2-ylphenyl)carbonylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-[4-(4-isopropylbenzoyl)piperazin-1-yl]-3-nitro-pyrido[1,2-a]pyrimidin-4-one CAS Name: 3-nitro-2-[4-[oxo-(4-propan-2-ylphenyl)methyl]-1-piperazinyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 3-nitro-2-[4-(4-propan-2-ylbenzoyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-(4-cumoylpiperazino)-3-nitro-pyrido[1,2-a]pyrimidin-4-one Formula: C22H23N5O4 MolecularWeight: 421.44912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O4/c1-15(2)16-6-8-17(9-7-16)21(28)25-13-11-24(12-14-25)20-19(27(30)31)22(29)26-10-4-3-5-18(26)23-20/h3-10,15H,11-14H2,1-2H3