1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone

Systemtic Name: 1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone Openeye Name: 1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone CAS Name: 1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone IUPAC Name: 1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone Traditional Name: 1-[6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidin-3-ium-5-yl]ethanone Formula: C19H19N4O5+ MolecularWeight: 383.37796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C([NH2+]C(N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C([NH2+]C(N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C19H18N4O5/c1-11-17(12(2)24)18(13-3-7-15(8-4-13)22(25)26)21-19(20-11)14-5-9-16(10-6-14)23(27)28/h3-10,18-21H,1-2H3/p+1