2-[(6-methyl-2-morpholin-4-yl-pyrimidin-4-yl)amino]benzoate

Systemtic Name: 2-[(6-methyl-2-morpholin-4-yl-pyrimidin-4-yl)amino]benzoate Openeye Name: 2-[(6-methyl-2-morpholino-pyrimidin-4-yl)amino]benzoate CAS Name: 2-[[6-methyl-2-(4-morpholinyl)-4-pyrimidinyl]amino]benzoate IUPAC Name: 2-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)amino]benzoate Traditional Name: 2-[(6-methyl-2-morpholino-pyrimidin-4-yl)amino]benzoate Formula: C16H17N4O3- MolecularWeight: 313.33118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCOCC2)NC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCOCC2)NC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C16H18N4O3/c1-11-10-14(18-13-5-3-2-4-12(13)15(21)22)19-16(17-11)20-6-8-23-9-7-20/h2-5,10H,6-9H2,1H3,(H,21,22)(H,17,18,19)/p-1