methyl 2-[methyl-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]amino]benzoate

Systemtic Name: methyl 2-[methyl-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 2-[methyl-[5-nitro-6-(2-phenylhydrazino)pyrimidin-4-yl]amino]benzoate CAS Name: 2-[methyl-[5-nitro-6-(phenylhydrazo)-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[methyl-[5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-yl]amino]benzoate Traditional Name: 2-[methyl-[5-nitro-6-(N'-phenylhydrazino)pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C19H18N6O4 MolecularWeight: 394.38402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C2=NC=NC(=C2[N+](=O)[O-])NNC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C2=NC=NC(=C2[N+](=O)[O-])NNC3=CC=CC=C3

InChI

InChI=1S/C19H18N6O4/c1-24(15-11-7-6-10-14(15)19(26)29-2)18-16(25(27)28)17(20-12-21-18)23-22-13-8-4-3-5-9-13/h3-12,22H,1-2H3,(H,20,21,23)