2-[[1,3-dicyclohexyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]-4-nitro-phenolate

Systemtic Name: 2-[[1,3-dicyclohexyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]-4-nitro-phenolate Openeye Name: 2-[(1,3-dicyclohexyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methylamino]-4-nitro-phenolate CAS Name: 2-[(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-4-nitrophenolate IUPAC Name: 2-[(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]-4-nitrophenolate Traditional Name: 2-[(1,3-dicyclohexyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)methylamino]-4-nitro-phenolate Formula: C23H27N4O6- MolecularWeight: 455.48368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)N(C2=O)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CNC3=C(C=CC(=C3)[N+](=O)[O-])[O-])C(=O)N(C2=O)C4CCCCC4

InChI

InChI=1S/C23H28N4O6/c28-20-12-11-17(27(32)33)13-19(20)24-14-18-21(29)25(15-7-3-1-4-8-15)23(31)26(22(18)30)16-9-5-2-6-10-16/h11-16,24,28H,1-10H2/p-1