4-[(E)-N-[(2,4-dinitrophenyl)amino]-C-methyl-carbonimidoyl]-3-methyl-6,6-diphenyl-1,2-dioxan-3-ol

Systemtic Name: 4-[(E)-N-[(2,4-dinitrophenyl)amino]-C-methyl-carbonimidoyl]-3-methyl-6,6-diphenyl-1,2-dioxan-3-ol Openeye Name: 4-[(E)-N-(2,4-dinitroanilino)-C-methyl-carbonimidoyl]-3-methyl-6,6-diphenyl-dioxan-3-ol CAS Name: 4-[(1E)-1-[(2,4-dinitrophenyl)hydrazinylidene]ethyl]-3-methyl-6,6-diphenyl-3-dioxanol IUPAC Name: 4-[(E)-N-(2,4-dinitroanilino)-C-methylcarbonimidoyl]-3-methyl-6,6-diphenyldioxan-3-ol Traditional Name: 4-[(E)-N-(2,4-dinitroanilino)-C-methyl-carbonimidoyl]-3-methyl-6,6-diphenyl-dioxan-3-ol Formula: C25H24N4O7 MolecularWeight: 492.48066

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C2CC(OOC2(C)O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])/C2CC(OOC2(C)O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O7/c1-17(26-27-22-14-13-20(28(31)32)15-23(22)29(33)34)21-16-25(36-35-24(21,2)30,18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-15,21,27,30H,16H2,1-2H3/b26-17+