methyl 2-[(6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-yl)amino]benzoate

Systemtic Name: methyl 2-[(6-naphthalen-1-yloxy-5-nitro-pyrimidin-4-yl)amino]benzoate Openeye Name: methyl 2-[[6-(1-naphthyloxy)-5-nitro-pyrimidin-4-yl]amino]benzoate CAS Name: 2-[[6-(1-naphthalenyloxy)-5-nitro-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-naphthalen-1-yloxy-5-nitropyrimidin-4-yl)amino]benzoate Traditional Name: 2-[[6-(1-naphthoxy)-5-nitro-pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C22H16N4O5 MolecularWeight: 416.38624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=C(C(=NC=N2)OC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O5/c1-30-22(27)16-10-4-5-11-17(16)25-20-19(26(28)29)21(24-13-23-20)31-18-12-6-8-14-7-2-3-9-15(14)18/h2-13H,1H3,(H,23,24,25)