1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium

Systemtic Name: 1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium Openeye Name: 1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium CAS Name: 1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium IUPAC Name: 1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium Traditional Name: 1-methyl-2,3-bis(2-nitrophenyl)-5,6-dihydro-4H-pyrimidin-1-ium Formula: C17H17N4O4+ MolecularWeight: 341.34128

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(N(CCC1)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C[N+]1=C(N(CCC1)C2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H17N4O4/c1-18-11-6-12-19(15-9-4-5-10-16(15)21(24)25)17(18)13-7-2-3-8-14(13)20(22)23/h2-5,7-10H,6,11-12H2,1H3/q+1