methyl 6-[2-(2,4-dinitrophenyl)hydrazinyl]-6-(5-methyl-2-oxidanylidene-imidazol-4-ylidene)hexanoate

Systemtic Name: methyl 6-[2-(2,4-dinitrophenyl)hydrazinyl]-6-(5-methyl-2-oxidanylidene-imidazol-4-ylidene)hexanoate Openeye Name: methyl 6-[2-(2,4-dinitrophenyl)hydrazino]-6-(5-methyl-2-oxo-imidazol-4-ylidene)hexanoate CAS Name: 6-[(2,4-dinitrophenyl)hydrazo]-6-(5-methyl-2-oxo-4-imidazolylidene)hexanoic acid methyl ester IUPAC Name: methyl 6-[2-(2,4-dinitrophenyl)hydrazinyl]-6-(5-methyl-2-oxoimidazol-4-ylidene)hexanoate Traditional Name: 6-[N'-(2,4-dinitrophenyl)hydrazino]-6-(2-keto-5-methyl-3-imidazolin-4-ylidene)hexanoic acid methyl ester Formula: C17H20N6O7 MolecularWeight: 420.3767

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)NC1=C(CCCCC(=O)OC)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=O)NC1=C(CCCCC(=O)OC)NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H20N6O7/c1-10-16(19-17(25)18-10)13(5-3-4-6-15(24)30-2)21-20-12-8-7-11(22(26)27)9-14(12)23(28)29/h7-9,20-21H,3-6H2,1-2H3,(H,19,25)