3-methylbutyl 4-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinyl]benzoate

Systemtic Name: 3-methylbutyl 4-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)hydrazinyl]benzoate Openeye Name: isopentyl 4-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)hydrazino]benzoate CAS Name: 4-[(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)hydrazo]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)hydrazinyl]benzoate Traditional Name: 4-[N'-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)hydrazino]benzoic acid isoamyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)NNC2=CC=C(C=C2)C(=O)OCCC(C)C)C

Isomeric SMILES

CC1=C(NC(=NC1=O)NNC2=CC=C(C=C2)C(=O)OCCC(C)C)C

InChI

InChI=1S/C18H24N4O3/c1-11(2)9-10-25-17(24)14-5-7-15(8-6-14)21-22-18-19-13(4)12(3)16(23)20-18/h5-8,11,21H,9-10H2,1-4H3,(H2,19,20,22,23)