2-methylpropyl 4-[(6-chloranyl-5-nitro-pyrimidin-4-yl)amino]benzoate

Systemtic Name: 2-methylpropyl 4-[(6-chloranyl-5-nitro-pyrimidin-4-yl)amino]benzoate Openeye Name: isobutyl 4-[(6-chloro-5-nitro-pyrimidin-4-yl)amino]benzoate CAS Name: 4-[(6-chloro-5-nitro-4-pyrimidinyl)amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[(6-chloro-5-nitropyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(6-chloro-5-nitro-pyrimidin-4-yl)amino]benzoic acid isobutyl ester Formula: C15H15ClN4O4 MolecularWeight: 350.757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)NC2=C(C(=NC=N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H15ClN4O4/c1-9(2)7-24-15(21)10-3-5-11(6-4-10)19-14-12(20(22)23)13(16)17-8-18-14/h3-6,8-9H,7H2,1-2H3,(H,17,18,19)